![GRF GRF](https://data.pdbj.org/pdbjplus/data/cc/svg/GRF.svg) | GRF | Name: | 5-O-phosphono-beta-D-ribofuranosylamine | Formula: | C5 H12 N O7 P | SMILES: | O=P(O)(O)OCC1OC(N)C(O)C1O | InChi: | InChI=1S/C5H12NO7P/c6-5-4(8)3(7)2(13-5)1-12-14(9,10)11/h2-5,7-8H,1,6H2,(H2,9,10,11)/t2-,3-,4-,5-/m1/s1 | Synonyms: | 5-O-phosphono-beta-D-ribosylamine | Definition date: | 2005-06-16 | Last modified: | 2020-07-17 | Identifier: | 5-O-phosphono-beta-D-ribofuranosylamine |
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![TYC TYC](https://data.pdbj.org/pdbjplus/data/cc/svg/TYC.svg) | TYC | Name: | L-TYROSINAMIDE | Formula: | C9 H12 N2 O2 | SMILES: | O=C(N)C(N)Cc1ccc(O)cc1 | InChi: | InChI=1S/C9H12N2O2/c10-8(9(11)13)5-6-1-3-7(12)4-2-6/h1-4,8,12H,5,10H2,(H2,11,13)/t8-/m0/s1 | Definition date: | 2004-12-06 | Last modified: | 2020-07-15 | Identifier: | L-tyrosinamide |
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![6C7 6C7](https://data.pdbj.org/pdbjplus/data/cc/svg/6C7.svg) | 6C7 | Name: | S-(3-methylbut-2-en-1-yl) trihydrogen thiodiphosphate | Formula: | C5 H12 O6 P2 S | SMILES: | OP(O)(OP(O)(SCC=C(C)C)=O)=O | InChi: | InChI=1S/C5H12O6P2S/c1-5(2)3-4-14-13(9,10)11-12(6,7)8/h3H,4H2,1-2H3,(H,9,10)(H2,6,7,8) | Synonyms: | DMASPP | Definition date: | 2016-03-09 | Last modified: | 2020-07-15 | Release date: | 2016-05-11 | Identifier: | S-(3-methylbut-2-en-1-yl) trihydrogen thiodiphosphate |
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![KZ2 KZ2](https://data.pdbj.org/pdbjplus/data/cc/svg/KZ2.svg) | KZ2 | Name: | 1-benzothiophene-7-carboxylic acid | Formula: | C9 H6 O2 S | SMILES: | OC(=O)c1cccc2ccsc12 | InChi: | InChI=1S/C9H6O2S/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h1-5H,(H,10,11) | Definition date: | 2019-07-05 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 1-benzothiophene-7-carboxylic acid |
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![K8N K8N](https://data.pdbj.org/pdbjplus/data/cc/svg/K8N.svg) | K8N | Name: | (1~{S},2~{R},3~{S},5~{R})-3-[2-(2-azanyl-3-bromanyl-quinolin-7-yl)ethyl]-5-(4-azanylpyrrolo[2,3-d]pyrimidin-7-yl)cyclop
entane-1,2-diol | Formula: | C22 H23 Br N6 O2 | SMILES: | Nc1nc2cc(CC[CH]3C[CH]([CH](O)[CH]3O)n4ccc5c(N)ncnc45)ccc2cc1Br | InChi: | InChI=1S/C22H23BrN6O2/c23-15-8-12-3-1-11(7-16(12)28-21(15)25)2-4-13-9-17(19(31)18(13)30)29-6-5-14-20(24)26-10-27-22(14)29/h1,3,5-8,10,13,17-19,30-31H,2,4,9H2,(H2,25,28)(H2,24,26,27)/t13-,17+,18+,19-/m0/s1 | Synonyms: | JNJ45031882 | Definition date: | 2019-05-02 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | (1~{S},2~{R},3~{S},5~{R})-3-[2-(2-azanyl-3-bromanyl-quinolin-7-yl)ethyl]-5-(4-azanylpyrrolo[2,3-d]pyrimidin-7-yl)cyclopentane-1,2-diol |
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![L4B L4B](https://data.pdbj.org/pdbjplus/data/cc/svg/L4B.svg) | L4B | Name: | (4~{a}~{R},4~{b}~{S},6~{a}~{R},11~{a}~{R},11~{b}~{S},13~{a}~{R})-1,1,4~{a},6~{a},11~{b}-pentamethyl-9,10-bis(oxidanyl)-
3,4,4~{b},5,6,11,11~{a},12,13,13~{a}-decahydro-2~{H}-indeno[2,1-a]phenanthrene-7-carboxylic acid | Formula: | C27 H38 O4 | SMILES: | CC1(C)CCC[C]2(C)[CH]1CC[C]3(C)[CH]2CC[C]4(C)[CH]3Cc5c(O)c(O)cc(C(O)=O)c45 | InChi: | InChI=1S/C27H38O4/c1-24(2)9-6-10-25(3)18(24)7-11-26(4)19(25)8-12-27(5)20(26)14-15-21(27)16(23(30)31)13-17(28)22(15)29/h13,18-20,28-29H,6-12,14H2,1-5H3,(H,30,31)/t18-,19+,20-,25-,26+,27-/m1/s1 | Synonyms: | merosterolic acid A | Definition date: | 2019-07-19 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | (4~{a}~{R},4~{b}~{S},6~{a}~{R},11~{a}~{R},11~{b}~{S},13~{a}~{R})-1,1,4~{a},6~{a},11~{b}-pentamethyl-9,10-bis(oxidanyl)-3,4,4~{b},5,6,11,11~{a},12,13,13~{a}-decahydro-2~{H}-indeno[2,1-a]phenanthrene-7-carboxylic acid |
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![L4E L4E](https://data.pdbj.org/pdbjplus/data/cc/svg/L4E.svg) | L4E | Name: | geranylgeranyl dihydroxybenzoate | Formula: | C27 H38 O4 | SMILES: | CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCc1cc(cc(O)c1O)C(O)=O | InChi: | InChI=1S/C27H38O4/c1-19(2)9-6-10-20(3)11-7-12-21(4)13-8-14-22(5)15-16-23-17-24(27(30)31)18-25(28)26(23)29/h9,11,13,15,17-18,28-29H,6-8,10,12,14,16H2,1-5H3,(H,30,31)/b20-11+,21-13+,22-15+ | Definition date: | 2019-07-19 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 3,4-bis(oxidanyl)-5-[(2~{E},6~{E},10~{E})-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]benzoic acid |
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![L4H L4H](https://data.pdbj.org/pdbjplus/data/cc/svg/L4H.svg) | L4H | Name: | farnesyl dihydroxybenzoate | Formula: | C22 H30 O4 | SMILES: | CC(C)=CCCC(C)=CCCC(C)=CCc1cc(cc(O)c1O)C(O)=O | InChi: | InChI=1S/C22H30O4/c1-15(2)7-5-8-16(3)9-6-10-17(4)11-12-18-13-19(22(25)26)14-20(23)21(18)24/h7,9,11,13-14,23-24H,5-6,8,10,12H2,1-4H3,(H,25,26)/b16-9+,17-11+ | Definition date: | 2019-07-19 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 3,4-bis(oxidanyl)-5-[(2~{E},6~{E})-3,7,11-trimethyldodeca-2,6,10-trienyl]benzoic acid |
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![JHC JHC](https://data.pdbj.org/pdbjplus/data/cc/svg/JHC.svg) | JHC | Name: | [(2S)-2-[(2S)-butan-2-yl]-4-(5-chloro-1,3-benzoxazol-2-yl)-1,4-diazepan-1-yl][5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl]methanone | Formula: | C26 H29 Cl N6 O2 | SMILES: | N3(c2oc1c(cc(cc1)Cl)n2)CC(C(CC)C)N(CCC3)C(=O)c4c(ccc(c4)C)n5nccn5 | InChi: | InChI=1S/C26H29ClN6O2/c1-4-18(3)23-16-31(26-30-21-15-19(27)7-9-24(21)35-26)12-5-13-32(23)25(34)20-14-17(2)6-8-22(20)33-28-10-11-29-33/h6-11,14-15,18,23H,4-5,12-13,16H2,1-3H3/t18-,23+/m0/s1 | Definition date: | 2019-12-20 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | [(2S)-2-[(2S)-butan-2-yl]-4-(5-chloro-1,3-benzoxazol-2-yl)-1,4-diazepan-1-yl][5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl]methanone |
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![O0Q O0Q](https://data.pdbj.org/pdbjplus/data/cc/svg/O0Q.svg) | O0Q | Name: | ~{N}-[2-(1,2,3-triazol-1-yl)ethyl]cubane-1-carboxamide | Formula: | C13 H14 N4 O | SMILES: | O=C(NCCn1ccnn1)C23C4C5C6C4C2C6C35 | InChi: | InChI=1S/C13H14N4O/c18-12(14-1-3-17-4-2-15-16-17)13-9-6-5-7(9)11(13)8(5)10(6)13/h2,4-11H,1,3H2,(H,14,18)/t5-,6+,7-,8+,9+,10-,11+,13+ | Definition date: | 2020-01-14 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | ~{N}-[2-(1,2,3-triazol-1-yl)ethyl]cubane-1-carboxamide |
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![QWY QWY](https://data.pdbj.org/pdbjplus/data/cc/svg/QWY.svg) | QWY | Name: | 3-amino-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide | Formula: | C21 H19 N5 O S2 | SMILES: | c1ccccc1c2sc(nn2)NC(=O)c5sc3c(cc4c(n3)CCCCC4)c5N | InChi: | InChI=1S/C21H19N5OS2/c22-16-14-11-13-9-5-2-6-10-15(13)23-20(14)28-17(16)18(27)24-21-26-25-19(29-21)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10,22H2,(H,24,26,27) | Definition date: | 2020-01-09 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 3-amino-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridine-2-carboxamide |
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![N9W N9W](https://data.pdbj.org/pdbjplus/data/cc/svg/N9W.svg) | N9W | Name: | 4-[(2-methyl-3,4-dihydro-1~{H}-pyrido[4,3-b]indol-5-yl)methyl]-~{N}-oxidanyl-benzamide | Formula: | C20 H21 N3 O2 | SMILES: | CN1CCc2n(Cc3ccc(cc3)C(=O)NO)c4ccccc4c2C1 | InChi: | InChI=1S/C20H21N3O2/c1-22-11-10-19-17(13-22)16-4-2-3-5-18(16)23(19)12-14-6-8-15(9-7-14)20(24)21-25/h2-9,25H,10-13H2,1H3,(H,21,24) | Definition date: | 2019-11-21 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 4-[(2-methyl-3,4-dihydro-1~{H}-pyrido[4,3-b]indol-5-yl)methyl]-~{N}-oxidanyl-benzamide |
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![KHC KHC](https://data.pdbj.org/pdbjplus/data/cc/svg/KHC.svg) | KHC | Name: | (4~{S})-7,8-bis(chloranyl)-9-methyl-1-oxidanylidene-spiro[2,4-dihydropyrido[3,4-b]indole-3,4'-piperidine]-4-carbonitrile | Formula: | C17 H16 Cl2 N4 O | SMILES: | Cn1c2c(Cl)c(Cl)ccc2c3[CH](C#N)C4(CCNCC4)NC(=O)c13 | InChi: | InChI=1S/C17H16Cl2N4O/c1-23-14-9(2-3-11(18)13(14)19)12-10(8-20)17(4-6-21-7-5-17)22-16(24)15(12)23/h2-3,10,21H,4-7H2,1H3,(H,22,24)/t10-/m0/s1 | Definition date: | 2020-04-24 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | (4~{S})-7,8-bis(chloranyl)-9-methyl-1-oxidanylidene-spiro[2,4-dihydropyrido[3,4-b]indole-3,4'-piperidine]-4-carbonitrile |
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![P1Q P1Q](https://data.pdbj.org/pdbjplus/data/cc/svg/P1Q.svg) | P1Q | Name: | 1-[(2~{R},5~{S})-2-(3-chlorophenyl)-5-methyl-morpholin-4-yl]-3-methoxy-propan-2-ol | Formula: | C15 H22 Cl N O3 | SMILES: | COCC(O)CN1C[CH](OC[CH]1C)c2cccc(Cl)c2 | InChi: | InChI=1S/C15H22ClNO3/c1-11-9-20-15(12-4-3-5-13(16)6-12)8-17(11)7-14(18)10-19-2/h3-6,11,14-15,18H,7-10H2,1-2H3/t11-,14?,15-/m0/s1 | Definition date: | 2020-04-14 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 1-[(2~{R},5~{S})-2-(3-chlorophenyl)-5-methyl-morpholin-4-yl]-3-methoxy-propan-2-ol |
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![KM5 KM5](https://data.pdbj.org/pdbjplus/data/cc/svg/KM5.svg) | KM5 | Name: | methyl 1-[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-ethyl-amino]phenyl]carbonylpiperidine-4-carboxylate | Formula: | C23 H28 N8 O3 | SMILES: | CCN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)N4CCC(CC4)C(=O)OC | InChi: | InChI=1S/C23H28N8O3/c1-3-30(13-16-12-26-20-18(27-16)19(24)28-23(25)29-20)17-6-4-14(5-7-17)21(32)31-10-8-15(9-11-31)22(33)34-2/h4-7,12,15H,3,8-11,13H2,1-2H3,(H4,24,25,26,28,29) | Definition date: | 2019-06-07 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | methyl 1-[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-ethyl-amino]phenyl]carbonylpiperidine-4-carboxylate |
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![QBV QBV](https://data.pdbj.org/pdbjplus/data/cc/svg/QBV.svg) | QBV | Name: | (2E)-3-(3-bromo-4-hydroxyphenyl)prop-2-enoic acid | Formula: | C9 H7 Br O3 | SMILES: | C([C@H]=Cc1ccc(c(c1)Br)O)(O)=O | InChi: | InChI=1S/C9H7BrO3/c10-7-5-6(1-3-8(7)11)2-4-9(12)13/h1-5,11H,(H,12,13)/b4-2+ | Definition date: | 2019-10-11 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | (2E)-3-(3-bromo-4-hydroxyphenyl)prop-2-enoic acid |
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![KMK KMK](https://data.pdbj.org/pdbjplus/data/cc/svg/KMK.svg) | KMK | Name: | methyl 1-[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-(3-oxidanylpropyl)amino]phenyl]carbonylpiperidine-4-carboxylate | Formula: | C24 H30 N8 O4 | SMILES: | COC(=O)C1CCN(CC1)C(=O)c2ccc(cc2)N(CCCO)Cc3cnc4nc(N)nc(N)c4n3 | InChi: | InChI=1S/C24H30N8O4/c1-36-23(35)16-7-10-31(11-8-16)22(34)15-3-5-18(6-4-15)32(9-2-12-33)14-17-13-27-21-19(28-17)20(25)29-24(26)30-21/h3-6,13,16,33H,2,7-12,14H2,1H3,(H4,25,26,27,29,30) | Definition date: | 2019-06-07 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | methyl 1-[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-(3-oxidanylpropyl)amino]phenyl]carbonylpiperidine-4-carboxylate |
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![KMW KMW](https://data.pdbj.org/pdbjplus/data/cc/svg/KMW.svg) | KMW | Name: | 3-(4-aminocarbonylphenoxy)benzamide | Formula: | C14 H12 N2 O3 | SMILES: | NC(=O)c1ccc(Oc2cccc(c2)C(N)=O)cc1 | InChi: | InChI=1S/C14H12N2O3/c15-13(17)9-4-6-11(7-5-9)19-12-3-1-2-10(8-12)14(16)18/h1-8H,(H2,15,17)(H2,16,18) | Definition date: | 2019-06-10 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 3-(4-aminocarbonylphenoxy)benzamide |
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![PJH PJH](https://data.pdbj.org/pdbjplus/data/cc/svg/PJH.svg) | PJH | Name: | ~{N}-methylpyridine-3-carboxamide | Formula: | C7 H8 N2 O | SMILES: | CNC(=O)c1cccnc1 | InChi: | InChI=1S/C7H8N2O/c1-8-7(10)6-3-2-4-9-5-6/h2-5H,1H3,(H,8,10) | Definition date: | 2020-04-22 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | ~{N}-methylpyridine-3-carboxamide |
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![QD2 QD2](https://data.pdbj.org/pdbjplus/data/cc/svg/QD2.svg) | QD2 | Name: | 4-[6-methoxy-5-(methylsulfamoyl)pyridin-3-yl]-~{N}-(1-methylpiperidin-4-yl)-2,3-dihydro-1,4-benzoxazine-6-carboxamide | Formula: | C22 H29 N5 O5 S | SMILES: | CN[S](=O)(=O)c1cc(cnc1OC)N2CCOc3ccc(cc23)C(=O)NC4CCN(C)CC4 | InChi: | InChI=1S/C22H29N5O5S/c1-23-33(29,30)20-13-17(14-24-22(20)31-3)27-10-11-32-19-5-4-15(12-18(19)27)21(28)25-16-6-8-26(2)9-7-16/h4-5,12-14,16,23H,6-11H2,1-3H3,(H,25,28) | Definition date: | 2020-06-08 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 4-[6-methoxy-5-(methylsulfamoyl)pyridin-3-yl]-~{N}-(1-methylpiperidin-4-yl)-2,3-dihydro-1,4-benzoxazine-6-carboxamide |
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![RJY RJY](https://data.pdbj.org/pdbjplus/data/cc/svg/RJY.svg) | RJY | Name: | ethyl 2-methyl-1,3-thiazole-4-carboxylate | Formula: | C7 H9 N O2 S | SMILES: | Cc1scc(C(=O)OCC)n1 | InChi: | InChI=1S/C7H9NO2S/c1-3-10-7(9)6-4-11-5(2)8-6/h4H,3H2,1-2H3 | Definition date: | 2020-02-13 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | ethyl 2-methyl-1,3-thiazole-4-carboxylate |
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![RK4 RK4](https://data.pdbj.org/pdbjplus/data/cc/svg/RK4.svg) | RK4 | Name: | 3-[(piperidin-1-yl)methyl]benzoic acid | Formula: | C13 H17 N O2 | SMILES: | C1CCN(CC1)Cc2cccc(C(=O)O)c2 | InChi: | InChI=1S/C13H17NO2/c15-13(16)12-6-4-5-11(9-12)10-14-7-2-1-3-8-14/h4-6,9H,1-3,7-8,10H2,(H,15,16) | Definition date: | 2020-02-13 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 3-[(piperidin-1-yl)methyl]benzoic acid |
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![P5H P5H](https://data.pdbj.org/pdbjplus/data/cc/svg/P5H.svg) | P5H | Name: | 6-methyl-~{N}-[2-(methylsulfonylamino)ethyl]-2-oxidanylidene-3~{H}-pyridine-3-carboxamide | Formula: | C10 H15 N3 O4 S | SMILES: | CC1=NC(=O)[CH](C=C1)C(=O)NCCN[S](C)(=O)=O | InChi: | InChI=1S/C10H15N3O4S/c1-7-3-4-8(10(15)13-7)9(14)11-5-6-12-18(2,16)17/h3-4,8,12H,5-6H2,1-2H3,(H,11,14)/t8-/m0/s1 | Definition date: | 2020-04-15 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 6-methyl-~{N}-[2-(methylsulfonylamino)ethyl]-2-oxidanylidene-3~{H}-pyridine-3-carboxamide |
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![PKB PKB](https://data.pdbj.org/pdbjplus/data/cc/svg/PKB.svg) | PKB | Name: | 4-(6-ethoxypyrazolo[1,5-b]pyridazin-3-yl)-~{N}-[3-methoxy-5-(trifluoromethyl)phenyl]pyrimidin-2-amine | Formula: | C20 H17 F3 N6 O2 | SMILES: | CCOc1ccc2n(ncc2c3ccnc(Nc4cc(OC)cc(c4)C(F)(F)F)n3)n1 | InChi: | InChI=1S/C20H17F3N6O2/c1-3-31-18-5-4-17-15(11-25-29(17)28-18)16-6-7-24-19(27-16)26-13-8-12(20(21,22)23)9-14(10-13)30-2/h4-11H,3H2,1-2H3,(H,24,26,27) | Definition date: | 2020-04-24 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 4-(6-ethoxypyrazolo[1,5-b]pyridazin-3-yl)-~{N}-[3-methoxy-5-(trifluoromethyl)phenyl]pyrimidin-2-amine |
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![P5W P5W](https://data.pdbj.org/pdbjplus/data/cc/svg/P5W.svg) | P5W | Name: | 4-[(4-phenyl-1,3-thiazol-2-yl)amino]benzoic acid | Formula: | C16 H12 N2 O2 S | SMILES: | OC(=O)c1ccc(Nc2scc(n2)c3ccccc3)cc1 | InChi: | InChI=1S/C16H12N2O2S/c19-15(20)12-6-8-13(9-7-12)17-16-18-14(10-21-16)11-4-2-1-3-5-11/h1-10H,(H,17,18)(H,19,20) | Definition date: | 2020-04-16 | Last modified: | 2020-07-10 | Release date: | 2020-07-15 | Identifier: | 4-[(4-phenyl-1,3-thiazol-2-yl)amino]benzoic acid |
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