![K0C K0C](https://data.pdbj.org/pdbjplus/data/cc/svg/K0C.svg) | K0C | Name: | 2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}-1H-imidazo[4,5-f]quinoline | Formula: | C19 H18 N4 O S | SMILES: | Cc1c(OC)c(C)cnc1CSc1nc2ccc3ncccc3c2[NH]1 | InChi: | InChI=1S/C19H18N4OS/c1-11-9-21-16(12(2)18(11)24-3)10-25-19-22-15-7-6-14-13(17(15)23-19)5-4-8-20-14/h4-9H,10H2,1-3H3,(H,22,23) | Definition date: | 2022-02-02 | Last modified: | 2022-10-07 | Release date: | 2022-10-12 | Identifier: | 2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}-1H-imidazo[4,5-f]quinoline |
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![K0R K0R](https://data.pdbj.org/pdbjplus/data/cc/svg/K0R.svg) | K0R | Name: | 4-chloro-1,3-dimethyl-N-[(4R)-2-phenylimidazo[1,2-a]pyrimidin-7-yl]-1H-pyrazole-5-carboxamide | Formula: | C18 H15 Cl N6 O | SMILES: | Clc1c(C(=O)Nc2ccn3cc(nc3n2)c2ccccc2)n(C)nc1C | InChi: | InChI=1S/C18H15ClN6O/c1-11-15(19)16(24(2)23-11)17(26)21-14-8-9-25-10-13(20-18(25)22-14)12-6-4-3-5-7-12/h3-10H,1-2H3,(H,20,21,22,26) | Definition date: | 2022-02-02 | Last modified: | 2022-10-07 | Release date: | 2022-10-12 | Identifier: | 4-chloro-1,3-dimethyl-N-[(4R)-2-phenylimidazo[1,2-a]pyrimidin-7-yl]-1H-pyrazole-5-carboxamide |
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![K18 K18](https://data.pdbj.org/pdbjplus/data/cc/svg/K18.svg) | K18 | Name: | N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-N'-(1-phenyl-1H-pyrazol-5-yl)urea | Formula: | C17 H20 N6 O | SMILES: | Cc1cc(C)nn1CCNC(=O)Nc1ccnn1c1ccccc1 | InChi: | InChI=1S/C17H20N6O/c1-13-12-14(2)22(21-13)11-10-18-17(24)20-16-8-9-19-23(16)15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H2,18,20,24) | Definition date: | 2022-02-02 | Last modified: | 2022-10-07 | Release date: | 2022-10-12 | Identifier: | N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-N'-(1-phenyl-1H-pyrazol-5-yl)urea |
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![K1I K1I](https://data.pdbj.org/pdbjplus/data/cc/svg/K1I.svg) | K1I | Name: | 3-[1-(2,2-difluoro-2H-1,3-benzodioxol-4-yl)-1H-pyrazol-5-yl]-1-[3-(methanesulfonyl)phenyl]pyridazin-4(1H)-one | Formula: | C21 H14 F2 N4 O5 S | SMILES: | CS(=O)(=O)c1cccc(c1)N1C=CC(=O)C(=N1)c1ccnn1c1cccc2OC(F)(F)Oc12 | InChi: | InChI=1S/C21H14F2N4O5S/c1-33(29,30)14-5-2-4-13(12-14)26-11-9-17(28)19(25-26)15-8-10-24-27(15)16-6-3-7-18-20(16)32-21(22,23)31-18/h2-12H,1H3 | Definition date: | 2022-02-02 | Last modified: | 2022-10-07 | Release date: | 2022-10-12 | Identifier: | 3-[1-(2,2-difluoro-2H-1,3-benzodioxol-4-yl)-1H-pyrazol-5-yl]-1-[3-(methanesulfonyl)phenyl]pyridazin-4(1H)-one |
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![K1X K1X](https://data.pdbj.org/pdbjplus/data/cc/svg/K1X.svg) | K1X | Name: | 3-[1-(quinolin-4-yl)-1H-pyrazol-5-yl]-1-[3-(trifluoromethoxy)phenyl]pyridazin-4(1H)-one | Formula: | C23 H14 F3 N5 O2 | SMILES: | FC(F)(F)Oc1cccc(c1)N1C=CC(=O)C(=N1)c1ccnn1c1ccnc2ccccc12 | InChi: | InChI=1S/C23H14F3N5O2/c24-23(25,26)33-16-5-3-4-15(14-16)30-13-10-21(32)22(29-30)20-9-12-28-31(20)19-8-11-27-18-7-2-1-6-17(18)19/h1-14H | Definition date: | 2022-02-02 | Last modified: | 2022-10-07 | Release date: | 2022-10-12 | Identifier: | 3-[1-(quinolin-4-yl)-1H-pyrazol-5-yl]-1-[3-(trifluoromethoxy)phenyl]pyridazin-4(1H)-one |
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![K2L K2L](https://data.pdbj.org/pdbjplus/data/cc/svg/K2L.svg) | K2L | Name: | 1-(2-{2-[(4S)-5,8-dimethyl[1,2,4]triazolo[1,5-c]pyrimidin-2-yl]ethyl}-1-methyl-1H-imidazol-4-yl)pyrrolidin-2-one | Formula: | C17 H21 N7 O | SMILES: | O=C1CCCN1c1nc(CCc2nc3c(C)cnc(C)n3n2)n(C)c1 | InChi: | InChI=1S/C17H21N7O/c1-11-9-18-12(2)24-17(11)19-13(21-24)6-7-14-20-15(10-22(14)3)23-8-4-5-16(23)25/h9-10H,4-8H2,1-3H3 | Definition date: | 2022-02-02 | Last modified: | 2022-10-07 | Release date: | 2022-10-12 | Identifier: | 1-(2-{2-[(4S)-5,8-dimethyl[1,2,4]triazolo[1,5-c]pyrimidin-2-yl]ethyl}-1-methyl-1H-imidazol-4-yl)pyrrolidin-2-one |
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![86W 86W](https://data.pdbj.org/pdbjplus/data/cc/svg/86W.svg) | 86W | Name: | 1,5-dimethyl-6-[2-methyl-4-[3-(trifluoromethyl)pyridin-2-yl]oxy-phenyl]pyrimidine-2,4-dione | Formula: | C19 H16 F3 N3 O3 | SMILES: | CN1C(=O)NC(=O)C(=C1c2ccc(Oc3ncccc3C(F)(F)F)cc2C)C | InChi: | InChI=1S/C19H16F3N3O3/c1-10-9-12(28-17-14(19(20,21)22)5-4-8-23-17)6-7-13(10)15-11(2)16(26)24-18(27)25(15)3/h4-9H,1-3H3,(H,24,26,27) | Synonyms: | Tavapadon | Definition date: | 2022-03-03 | Last modified: | 2022-10-06 | Release date: | 2022-06-15 | Identifier: | 1,5-dimethyl-6-[2-methyl-4-[3-(trifluoromethyl)pyridin-2-yl]oxy-phenyl]pyrimidine-2,4-dione |
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![Z80 Z80](https://data.pdbj.org/pdbjplus/data/cc/svg/Z80.svg) | Z80 | Name: | 3-(2-chloro-10H-phenothiazin-10-yl)-N,N-dimethylpropan-1-amine | Formula: | C17 H19 Cl N2 S | SMILES: | CN(C)CCCN1c2ccccc2Sc3ccc(Cl)cc13 | InChi: | InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3 | Synonyms: | Chlorpromazine | Definition date: | 2010-02-24 | Last modified: | 2022-10-05 | Identifier: | 3-(2-chlorophenothiazin-10-yl)-N,N-dimethyl-propan-1-amine |
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![F86 F86](https://data.pdbj.org/pdbjplus/data/cc/svg/F86.svg) | F86 | Name: | [(2~{R},3~{S},4~{R},5~{R})-5-(4-azanylpyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate | Formula: | C12 H14 N5 O7 P | SMILES: | OP(=O)(O)OCC1OC(C#N)(C(O)C1O)c1ccc2c(N)ncnn21 | InChi: | InChI=1S/C12H14N5O7P/c13-4-12(8-2-1-6-11(14)15-5-16-17(6)8)10(19)9(18)7(24-12)3-23-25(20,21)22/h1-2,5,7,9-10,18-19H,3H2,(H2,14,15,16)(H2,20,21,22)/t7-,9-,10-,12+/m1/s1 | Synonyms: | Remdesivir, bound form | Definition date: | 2020-04-14 | Last modified: | 2022-10-05 | Release date: | 2020-04-22 | Identifier: | {(2R,3S,4R,5R)-5-[(8R)-4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl]-5-cyano-3,4-dihydroxyoxolan-2-yl}methyl dihydrogen phosphate (non-preferred name) |
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![IG7 IG7](https://data.pdbj.org/pdbjplus/data/cc/svg/IG7.svg) | IG7 | Name: | [(2~{S})-3-[(2~{S})-3-azanyl-2-(hexadecanoylamino)-3-oxidanylidene-propyl]sulfanyl-2-hexadecanoyloxy-propyl] hexadecanoate | Formula: | C54 H104 N2 O6 S | SMILES: | CCCCCCCCCCCCCCCC(=O)N[CH](CSC[CH](COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)C(N)=O | InChi: | InChI=1S/C54H104N2O6S/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-51(57)56-50(54(55)60)48-63-47-49(62-53(59)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)46-61-52(58)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h49-50H,4-48H2,1-3H3,(H2,55,60)(H,56,57)/t49-,50+/m0/s1 | Definition date: | 2022-03-18 | Last modified: | 2022-10-05 | Release date: | 2022-09-07 | Identifier: | [(2~{S})-3-[(2~{S})-3-azanyl-2-(hexadecanoylamino)-3-oxidanylidene-propyl]sulfanyl-2-hexadecanoyloxy-propyl] hexadecanoate |
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![IRM IRM](https://data.pdbj.org/pdbjplus/data/cc/svg/IRM.svg) | IRM | Name: | 1,2-Dihydro-psi,psi-caroten-1-ol | Formula: | C40 H58 O | SMILES: | CC(C)=CCCC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCCC(C)(C)O | InChi: | InChI=1S/C40H58O/c1-33(2)19-13-22-36(5)25-16-28-37(6)26-14-23-34(3)20-11-12-21-35(4)24-15-27-38(7)29-17-30-39(8)31-18-32-40(9,10)41/h11-12,14-17,19-21,23-30,41H,13,18,22,31-32H2,1-10H3/b12-11+,23-14+,24-15+,28-16+,29-17+,34-20+,35-21+,36-25+,37-26+,38-27+,39-30+ | Synonyms: | Rhodopin | Definition date: | 2022-04-07 | Last modified: | 2022-10-05 | Release date: | 2022-10-05 | Identifier: | (6~{E},8~{E},10~{E},12~{E},14~{E},16~{E},18~{E},20~{E},22~{E},24~{E},26~{E})-2,6,10,14,19,23,27,31-octamethyldotriaconta-6,8,10,12,14,16,18,20,22,24,26,30-dodecaen-2-ol |
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![9B0 9B0](https://data.pdbj.org/pdbjplus/data/cc/svg/9B0.svg) | 9B0 | Name: | [(2~{S},3~{S},4~{E},6~{S},7~{R},10~{R})-3,7-dimethyl-2-[(2~{E},4~{E},6~{R})-6-methyl-6-oxidanyl-7-[(2~{R},3~{R})-3-[(2~{R},3~{S})-3-oxidanylpentan-2-yl]oxiran-2-yl]hepta-2,4-dien-2-yl]-7,10-bis(oxidanyl)-12-oxidanylidene-1-oxacyclododec-4-en-6-yl] 4-cycloheptylpiperazine-1-carboxylate | Formula: | C40 H66 N2 O9 | SMILES: | CC[CH](O)[CH](C)[CH]1O[CH]1C[C](C)(O)C=CC=C(C)[CH]2OC(=O)C[CH](O)CC[C](C)(O)[CH](OC(=O)N3CCN(CC3)C4CCCCCC4)C=C[CH]2C | InChi: | InChI=1S/C40H66N2O9/c1-7-32(44)29(4)37-33(49-37)26-39(5,47)19-12-13-27(2)36-28(3)16-17-34(40(6,48)20-18-31(43)25-35(45)51-36)50-38(46)42-23-21-41(22-24-42)30-14-10-8-9-11-15-30/h12-13,16-17,19,28-34,36-37,43-44,47-48H,7-11,14-15,18,20-26H2,1-6H3/b17-16+,19-12+,27-13+/t28-,29+,31+,32-,33+,34-,36+,37+,39-,40+/m0/s1 | Definition date: | 2018-03-01 | Last modified: | 2022-10-04 | Release date: | 2018-03-21 | Identifier: | [(2~{S},3~{S},4~{E},6~{S},7~{R},10~{R})-3,7-dimethyl-2-[(2~{E},4~{E},6~{R})-6-methyl-6-oxidanyl-7-[(2~{R},3~{R})-3-[(2~{R},3~{S})-3-oxidanylpentan-2-yl]oxiran-2-yl]hepta-2,4-dien-2-yl]-7,10-bis(oxidanyl)-12-oxidanylidene-1-oxacyclododec-4-en-6-yl] 4-cycloheptylpiperazine-1-carboxylate |
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![2KW 2KW](https://data.pdbj.org/pdbjplus/data/cc/svg/2KW.svg) | 2KW | Name: | 3-chloro-5-({1-[(4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]-2-oxo-4-(trifluoromethyl)-1,2-dihydropyridin-3-yl}oxy)benzonitrile | Formula: | C17 H11 Cl F3 N5 O3 | SMILES: | FC(F)(F)C2=C(Oc1cc(C#N)cc(Cl)c1)C(=O)N(C=C2)CC3=NNC(=O)N3C | InChi: | InChI=1S/C17H11ClF3N5O3/c1-25-13(23-24-16(25)28)8-26-3-2-12(17(19,20)21)14(15(26)27)29-11-5-9(7-22)4-10(18)6-11/h2-6H,8H2,1H3,(H,24,28) | Synonyms: | Doravirine | Definition date: | 2013-11-21 | Last modified: | 2022-10-03 | Release date: | 2014-02-12 | Identifier: | 3-chloro-5-({1-[(4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]-2-oxo-4-(trifluoromethyl)-1,2-dihydropyridin-3-yl}oxy)benzonitrile |
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![WIU WIU](https://data.pdbj.org/pdbjplus/data/cc/svg/WIU.svg) | WIU | Name: | (2R)-2-({4-[(5-tert-butyl-1-methyl-1H-pyrazol-3-yl)amino]-1H-pyrazolo[3,4-d]pyrimidin-6-yl}amino)-2-phenylethyl (2-aminoethyl)carbamate | Formula: | C24 H32 N10 O2 | SMILES: | CC(C)(C)c1cc(nn1C)Nc1nc(nc2[NH]ncc12)NC(COC(=O)NCCN)c1ccccc1 | InChi: | InChI=1S/C24H32N10O2/c1-24(2,3)18-12-19(33-34(18)4)29-20-16-13-27-32-21(16)31-22(30-20)28-17(15-8-6-5-7-9-15)14-36-23(35)26-11-10-25/h5-9,12-13,17H,10-11,14,25H2,1-4H3,(H,26,35)(H3,27,28,29,30,31,32,33)/t17-/m0/s1 | Definition date: | 2022-09-13 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | (2R)-2-({4-[(5-tert-butyl-1-methyl-1H-pyrazol-3-yl)amino]-1H-pyrazolo[3,4-d]pyrimidin-6-yl}amino)-2-phenylethyl (2-aminoethyl)carbamate |
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![K6L K6L](https://data.pdbj.org/pdbjplus/data/cc/svg/K6L.svg) | K6L | Name: | [(2~{R})-2-[5-(2-hexylphenyl)pentanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate | Formula: | C20 H34 N O6 P | SMILES: | CCCCCCc1ccccc1CCCCC(=O)N[CH](CO)CO[P](O)(O)=O | InChi: | InChI=1S/C20H34NO6P/c1-2-3-4-5-10-17-11-6-7-12-18(17)13-8-9-14-20(23)21-19(15-22)16-27-28(24,25)26/h6-7,11-12,19,22H,2-5,8-10,13-16H2,1H3,(H,21,23)(H2,24,25,26)/t19-/m1/s1 | Definition date: | 2022-09-11 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | [(2~{R})-2-[5-(2-hexylphenyl)pentanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate |
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![NUN NUN](https://data.pdbj.org/pdbjplus/data/cc/svg/NUN.svg) | NUN | Name: | 1-[(benzo[h]quinazolin-2-yl)sulfanyl]-3,3-dimethylbutan-2-one | Formula: | C18 H18 N2 O S | SMILES: | CC(C)(C)C(=O)CSc1nc2c3ccccc3ccc2cn1 | InChi: | InChI=1S/C18H18N2OS/c1-18(2,3)15(21)11-22-17-19-10-13-9-8-12-6-4-5-7-14(12)16(13)20-17/h4-10H,11H2,1-3H3 | Definition date: | 2022-04-08 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | 1-[(benzo[h]quinazolin-2-yl)sulfanyl]-3,3-dimethylbutan-2-one |
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![NUU NUU](https://data.pdbj.org/pdbjplus/data/cc/svg/NUU.svg) | NUU | Name: | 1-{[(10aP)-5,6-dihydropyrido[2,3-h]quinazolin-2-yl]sulfanyl}-3,3-dimethylbutan-2-one | Formula: | C17 H19 N3 O S | SMILES: | CC(C)(C)C(=O)CSc1nc2c(CCc3ncccc32)cn1 | InChi: | InChI=1S/C17H19N3OS/c1-17(2,3)14(21)10-22-16-19-9-11-6-7-13-12(15(11)20-16)5-4-8-18-13/h4-5,8-9H,6-7,10H2,1-3H3 | Definition date: | 2022-04-08 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | 1-{[(10aP)-5,6-dihydropyrido[2,3-h]quinazolin-2-yl]sulfanyl}-3,3-dimethylbutan-2-one |
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![NV3 NV3](https://data.pdbj.org/pdbjplus/data/cc/svg/NV3.svg) | NV3 | Name: | 1-[(9-chlorobenzo[h]quinazolin-2-yl)sulfanyl]-3,3-dimethylbutan-2-one | Formula: | C18 H17 Cl N2 O S | SMILES: | CC(C)(C)C(=O)CSc1nc2c3cc(Cl)ccc3ccc2cn1 | InChi: | InChI=1S/C18H17ClN2OS/c1-18(2,3)15(22)10-23-17-20-9-12-5-4-11-6-7-13(19)8-14(11)16(12)21-17/h4-9H,10H2,1-3H3 | Definition date: | 2022-04-11 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | 1-[(9-chlorobenzo[h]quinazolin-2-yl)sulfanyl]-3,3-dimethylbutan-2-one |
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![NVF NVF](https://data.pdbj.org/pdbjplus/data/cc/svg/NVF.svg) | NVF | Name: | 1-{[(9aM)-5,6-dihydrothieno[2,3-h]quinazolin-2-yl]sulfanyl}-3,3-dimethylbutan-2-one | Formula: | C16 H18 N2 O S2 | SMILES: | CC(C)(C)C(=O)CSc1ncc2CCc3sccc3c2n1 | InChi: | InChI=1S/C16H18N2OS2/c1-16(2,3)13(19)9-21-15-17-8-10-4-5-12-11(6-7-20-12)14(10)18-15/h6-8H,4-5,9H2,1-3H3 | Definition date: | 2022-04-11 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | 1-{[(9aM)-5,6-dihydrothieno[2,3-h]quinazolin-2-yl]sulfanyl}-3,3-dimethylbutan-2-one |
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![ZE0 ZE0](https://data.pdbj.org/pdbjplus/data/cc/svg/ZE0.svg) | ZE0 | Name: | (3'E)-3',4'-didehydro-1,2-dihydro-psi,psi-caroten-1-ol | Formula: | C40 H56 O | SMILES: | OC(C)(C)CCCC(=CC=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC=C(C=CC=C(C)C)C)C)C)C)C)C | InChi: | InChI=1S/C40H56O/c1-33(2)19-13-22-36(5)25-16-28-37(6)26-14-23-34(3)20-11-12-21-35(4)24-15-27-38(7)29-17-30-39(8)31-18-32-40(9,10)41/h11-17,19-30,41H,18,31-32H2,1-10H3/b12-11+,22-13+,23-14+,24-15+,28-16+,29-17+,34-20+,35-21+,36-25+,37-26+,38-27+,39-30+ | Definition date: | 2012-12-18 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | (3'E)-3',4'-didehydro-1,2-dihydro-psi,psi-caroten-1-ol |
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![WFW WFW](https://data.pdbj.org/pdbjplus/data/cc/svg/WFW.svg) | WFW | Name: | benzyl [2-(6-{[2-(4-amino-7H-pyrrolo[2,3-d]pyrimidin-7-yl)ethyl]carbamoyl}-5-hydroxy-4-oxo-1,4-dihydropyrimidin-2-yl)propan-2-yl]carbamate | Formula: | C24 H26 N8 O5 | SMILES: | O=C(OCc1ccccc1)NC(C)(C)C1=NC(=O)C(O)=C(N1)C(=O)NCCn1ccc2c(N)ncnc21 | InChi: | InChI=1S/C24H26N8O5/c1-24(2,31-23(36)37-12-14-6-4-3-5-7-14)22-29-16(17(33)21(35)30-22)20(34)26-9-11-32-10-8-15-18(25)27-13-28-19(15)32/h3-8,10,13,33H,9,11-12H2,1-2H3,(H,26,34)(H,31,36)(H2,25,27,28)(H,29,30,35) | Definition date: | 2022-09-07 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | benzyl [2-(6-{[2-(4-amino-7H-pyrrolo[2,3-d]pyrimidin-7-yl)ethyl]carbamoyl}-5-hydroxy-4-oxo-1,4-dihydropyrimidin-2-yl)propan-2-yl]carbamate |
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![82Q 82Q](https://data.pdbj.org/pdbjplus/data/cc/svg/82Q.svg) | 82Q | Name: | (2~{R},4~{R})-1-ethanoyl-~{N}-naphthalen-1-yl-4-phenyl-pyrrolidine-2-carboxamide | Formula: | C23 H22 N2 O2 | SMILES: | CC(=O)N1C[CH](C[CH]1C(=O)Nc2cccc3ccccc23)c4ccccc4 | InChi: | InChI=1S/C23H22N2O2/c1-16(26)25-15-19(17-8-3-2-4-9-17)14-22(25)23(27)24-21-13-7-11-18-10-5-6-12-20(18)21/h2-13,19,22H,14-15H2,1H3,(H,24,27)/t19-,22+/m0/s1 | Definition date: | 2021-09-28 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | (2~{R},4~{R})-1-ethanoyl-~{N}-naphthalen-1-yl-4-phenyl-pyrrolidine-2-carboxamide |
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![85Q 85Q](https://data.pdbj.org/pdbjplus/data/cc/svg/85Q.svg) | 85Q | Name: | (2R,4R)-1-(2-chloranylethanoyl)-N-(3-chlorophenyl)-4-phenyl-pyrrolidine-2-carboxamide | Formula: | C19 H18 Cl2 N2 O2 | SMILES: | ClCC(=O)N1C[CH](C[CH]1C(=O)Nc2cccc(Cl)c2)c3ccccc3 | InChi: | InChI=1S/C19H18Cl2N2O2/c20-11-18(24)23-12-14(13-5-2-1-3-6-13)9-17(23)19(25)22-16-8-4-7-15(21)10-16/h1-8,10,14,17H,9,11-12H2,(H,22,25)/t14-,17+/m0/s1 | Definition date: | 2021-10-04 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | (2~{R},4~{R})-1-(2-chloranylethanoyl)-~{N}-(3-chlorophenyl)-4-phenyl-pyrrolidine-2-carboxamide |
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![86G 86G](https://data.pdbj.org/pdbjplus/data/cc/svg/86G.svg) | 86G | Name: | 2-[3-(methoxymethyl)phenyl]-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide | Formula: | C19 H19 N3 O2 | SMILES: | COCc1cccc(c1)CC(=O)Nc1ccc(cc1)c1c[NH]nc1 | InChi: | InChI=1S/C19H19N3O2/c1-24-13-15-4-2-3-14(9-15)10-19(23)22-18-7-5-16(6-8-18)17-11-20-21-12-17/h2-9,11-12H,10,13H2,1H3,(H,20,21)(H,22,23) | Definition date: | 2021-09-08 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | 2-[3-(methoxymethyl)phenyl]-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide |
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![86K 86K](https://data.pdbj.org/pdbjplus/data/cc/svg/86K.svg) | 86K | Name: | 2-[methyl(phenyl)amino]-1-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridin-1(2H)-yl]ethan-1-one | Formula: | C21 H22 N4 O | SMILES: | O=C(CN(C)c1ccccc1)N1CC=C(CC1)c1c[NH]c2ncccc12 | InChi: | InChI=1S/C21H22N4O/c1-24(17-6-3-2-4-7-17)15-20(26)25-12-9-16(10-13-25)19-14-23-21-18(19)8-5-11-22-21/h2-9,11,14H,10,12-13,15H2,1H3,(H,22,23) | Definition date: | 2021-09-08 | Last modified: | 2022-09-30 | Release date: | 2022-10-05 | Identifier: | 2-[methyl(phenyl)amino]-1-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydropyridin-1(2H)-yl]ethan-1-one |
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