![EC3 EC3](https://data.pdbj.org/pdbjplus/data/cc/svg/EC3.svg) | EC3 | Name: | 1-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]pyrrolidin-2-one | Formula: | C14 H13 Cl N2 O2 | SMILES: | Oc1c(CN2CCCC2=O)cc(Cl)c3cccnc13 | InChi: | InChI=1S/C14H13ClN2O2/c15-11-7-9(8-17-6-2-4-12(17)18)14(19)13-10(11)3-1-5-16-13/h1,3,5,7,19H,2,4,6,8H2 | Definition date: | 2019-12-10 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | 1-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]pyrrolidin-2-one |
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![ECU ECU](https://data.pdbj.org/pdbjplus/data/cc/svg/ECU.svg) | ECU | Name: | 2-azanyl-7-bromanyl-4-imidazol-1-yl-quinolin-8-ol | Formula: | C12 H9 Br N4 O | SMILES: | Nc1cc(n2ccnc2)c3ccc(Br)c(O)c3n1 | InChi: | InChI=1S/C12H9BrN4O/c13-8-2-1-7-9(17-4-3-15-6-17)5-10(14)16-11(7)12(8)18/h1-6,18H,(H2,14,16) | Definition date: | 2019-12-10 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | 2-azanyl-7-bromanyl-4-imidazol-1-yl-quinolin-8-ol |
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![EBO EBO](https://data.pdbj.org/pdbjplus/data/cc/svg/EBO.svg) | EBO | Name: | (2~{S})-2-azanyl-4-[(3~{S})-3-[(~{E})-[2-methyl-3-oxidanyl-5-(phosphonomethyl)pyridin-4-yl]methylideneamino]-4-oxidanyl-4-oxidanylidene-butyl]sulfanyl-butanoic acid | Formula: | C16 H24 N3 O8 P S | SMILES: | Cc1ncc(C[P](O)(O)=O)c(C=N[CH](CCSCC[CH](N)C(O)=O)C(O)=O)c1O | InChi: | InChI=1S/C16H24N3O8PS/c1-9-14(20)11(10(6-18-9)8-28(25,26)27)7-19-13(16(23)24)3-5-29-4-2-12(17)15(21)22/h6-7,12-13,20H,2-5,8,17H2,1H3,(H,21,22)(H,23,24)(H2,25,26,27)/b19-7+/t12-,13-/m0/s1 | Definition date: | 2019-12-06 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | (2~{S})-2-azanyl-4-[(3~{S})-3-[(~{E})-[2-methyl-3-oxidanyl-5-(phosphonomethyl)pyridin-4-yl]methylideneamino]-4-oxidanyl-4-oxidanylidene-butyl]sulfanyl-butanoic acid |
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![KLK KLK](https://data.pdbj.org/pdbjplus/data/cc/svg/KLK.svg) | KLK | Name: | ~{N},3-dimethyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide | Formula: | C12 H16 N2 O2 | SMILES: | CNC(=O)c1[nH]c(C)c2C(=O)CCCCc12 | InChi: | InChI=1S/C12H16N2O2/c1-7-10-8(5-3-4-6-9(10)15)11(14-7)12(16)13-2/h14H,3-6H2,1-2H3,(H,13,16) | Definition date: | 2019-06-05 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | ~{N},3-dimethyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide |
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![KUH KUH](https://data.pdbj.org/pdbjplus/data/cc/svg/KUH.svg) | KUH | Name: | ~{N}-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide | Formula: | C22 H29 N3 O5 S | SMILES: | CCN(CC)[S](=O)(=O)c1ccc(OC)c(NC(=O)c2[nH]c(C)c3C(=O)CCCCc23)c1 | InChi: | InChI=1S/C22H29N3O5S/c1-5-25(6-2)31(28,29)15-11-12-19(30-4)17(13-15)24-22(27)21-16-9-7-8-10-18(26)20(16)14(3)23-21/h11-13,23H,5-10H2,1-4H3,(H,24,27) | Definition date: | 2019-06-27 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | ~{N}-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide |
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![KXK KXK](https://data.pdbj.org/pdbjplus/data/cc/svg/KXK.svg) | KXK | Name: | ~{N}-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide | Formula: | C24 H31 N3 O5 S | SMILES: | COc1ccc(cc1NC(=O)c2[nH]c(C)c3C(=O)CCCCc23)[S](=O)(=O)N4CCCCCC4 | InChi: | InChI=1S/C24H31N3O5S/c1-16-22-18(9-5-6-10-20(22)28)23(25-16)24(29)26-19-15-17(11-12-21(19)32-2)33(30,31)27-13-7-3-4-8-14-27/h11-12,15,25H,3-10,13-14H2,1-2H3,(H,26,29) | Definition date: | 2019-07-03 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | ~{N}-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide |
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![L25 L25](https://data.pdbj.org/pdbjplus/data/cc/svg/L25.svg) | L25 | Name: | ~{N}-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide | Formula: | C22 H27 N3 O6 S | SMILES: | COc1ccc(cc1NC(=O)c2[nH]c(C)c3C(=O)CCCCc23)[S](=O)(=O)N4CCOCC4 | InChi: | InChI=1S/C22H27N3O6S/c1-14-20-16(5-3-4-6-18(20)26)21(23-14)22(27)24-17-13-15(7-8-19(17)30-2)32(28,29)25-9-11-31-12-10-25/h7-8,13,23H,3-6,9-12H2,1-2H3,(H,24,27) | Definition date: | 2019-07-16 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | ~{N}-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide |
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![L2N L2N](https://data.pdbj.org/pdbjplus/data/cc/svg/L2N.svg) | L2N | Name: | ~{N}-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide | Formula: | C23 H30 N4 O5 S | SMILES: | COc1ccc(cc1NC(=O)c2[nH]c(C)c3C(=O)CCCCc23)[S](=O)(=O)N4CCN(C)CC4 | InChi: | InChI=1S/C23H30N4O5S/c1-15-21-17(6-4-5-7-19(21)28)22(24-15)23(29)25-18-14-16(8-9-20(18)32-3)33(30,31)27-12-10-26(2)11-13-27/h8-9,14,24H,4-7,10-13H2,1-3H3,(H,25,29) | Definition date: | 2019-07-16 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | ~{N}-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide |
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![L2W L2W](https://data.pdbj.org/pdbjplus/data/cc/svg/L2W.svg) | L2W | Name: | ~{N}-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide | Formula: | C23 H29 N3 O5 S | SMILES: | COc1ccc(cc1NC(=O)c2[nH]c(C)c3C(=O)CCCCc23)[S](=O)(=O)N4CCCCC4 | InChi: | InChI=1S/C23H29N3O5S/c1-15-21-17(8-4-5-9-19(21)27)22(24-15)23(28)25-18-14-16(10-11-20(18)31-2)32(29,30)26-12-6-3-7-13-26/h10-11,14,24H,3-9,12-13H2,1-2H3,(H,25,28) | Definition date: | 2019-07-17 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | ~{N}-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide |
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![L45 L45](https://data.pdbj.org/pdbjplus/data/cc/svg/L45.svg) | L45 | Name: | ~{N}-[5-(diethylsulfamoyl)-2-oxidanyl-phenyl]-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide | Formula: | C21 H27 N3 O5 S | SMILES: | CCN(CC)[S](=O)(=O)c1ccc(O)c(NC(=O)c2[nH]c(C)c3C(=O)CCCCc23)c1 | InChi: | InChI=1S/C21H27N3O5S/c1-4-24(5-2)30(28,29)14-10-11-17(25)16(12-14)23-21(27)20-15-8-6-7-9-18(26)19(15)13(3)22-20/h10-12,22,25H,4-9H2,1-3H3,(H,23,27) | Definition date: | 2019-07-19 | Last modified: | 2020-12-04 | Release date: | 2020-12-09 | Identifier: | ~{N}-[5-(diethylsulfamoyl)-2-oxidanyl-phenyl]-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide |
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![V2G V2G](https://data.pdbj.org/pdbjplus/data/cc/svg/V2G.svg) | V2G | Name: | 2-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]amino]ethanoic acid | Formula: | C12 H17 N6 O8 P | SMILES: | N(CC(O)=O)P(O)(=O)OCC1OC(C(C1O)O)n2cnc3c2ncnc3N | InChi: | InChI=1S/C12H17N6O8P/c13-10-7-11(15-3-14-10)18(4-16-7)12-9(22)8(21)5(26-12)2-25-27(23,24)17-1-6(19)20/h3-5,8-9,12,21-22H,1-2H2,(H,19,20)(H2,13,14,15)(H2,17,23,24)/t5-,8-,9-,12-/m1/s1 | Definition date: | 2020-06-19 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | {[(S)-{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(hydroxy)phosphoryl]amino}acetic acid (non-preferred name) |
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![S7W S7W](https://data.pdbj.org/pdbjplus/data/cc/svg/S7W.svg) | S7W | Name: | TEGAFUR | Formula: | C8 H9 F N2 O3 | SMILES: | FC1=CN([CH]2CCCO2)C(=O)NC1=O | InChi: | InChI=1S/C8H9FN2O3/c9-5-4-11(6-2-1-3-14-6)8(13)10-7(5)12/h4,6H,1-3H2,(H,10,12,13)/t6-/m1/s1 | Definition date: | 2020-11-11 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | 5-fluoranyl-1-[(2~{R})-oxolan-2-yl]pyrimidine-2,4-dione |
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![RT2 RT2](https://data.pdbj.org/pdbjplus/data/cc/svg/RT2.svg) | RT2 | Name: | Tofogliflozin | Formula: | C22 H26 O6 | SMILES: | CCc1ccc(Cc2ccc3CO[C]4(O[CH](CO)[CH](O)[CH](O)[CH]4O)c3c2)cc1 | InChi: | InChI=1S/C22H26O6/c1-2-13-3-5-14(6-4-13)9-15-7-8-16-12-27-22(17(16)10-15)21(26)20(25)19(24)18(11-23)28-22/h3-8,10,18-21,23-26H,2,9,11-12H2,1H3/t18-,19-,20+,21+,22+/m1/s1 | Definition date: | 2020-10-20 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | (3~{S},3'~{S},4'~{S},5'~{S},6'~{R})-5-[(4-ethylphenyl)methyl]-6'-(hydroxymethyl)spiro[1~{H}-2-benzofuran-3,2'-oxane]-3',4',5'-triol |
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![S8B S8B](https://data.pdbj.org/pdbjplus/data/cc/svg/S8B.svg) | S8B | Name: | ~{N}-propan-2-yl-5-(2-pyridin-4-ylethynyl)pyridine-2-carboxamide | Formula: | C16 H15 N3 O | SMILES: | CC(C)NC(=O)c1ccc(cn1)C#Cc2ccncc2 | InChi: | InChI=1S/C16H15N3O/c1-12(2)19-16(20)15-6-5-14(11-18-15)4-3-13-7-9-17-10-8-13/h5-12H,1-2H3,(H,19,20) | Definition date: | 2020-11-11 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | ~{N}-propan-2-yl-5-(2-pyridin-4-ylethynyl)pyridine-2-carboxamide |
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![S8H S8H](https://data.pdbj.org/pdbjplus/data/cc/svg/S8H.svg) | S8H | Name: | (2~{S})-2-azanyl-5-oxidanylidene-5-[[(2~{S})-1-oxidanylidene-1-[(2-oxidanylidene-2-propan-2-yloxy-ethyl)amino]-3-sulfanyl-propan-2-yl]amino]pentanoic acid | Formula: | C13 H23 N3 O6 S | SMILES: | CC(C)OC(=O)CNC(=O)[CH](CS)NC(=O)CC[CH](N)C(O)=O | InChi: | InChI=1S/C13H23N3O6S/c1-7(2)22-11(18)5-15-12(19)9(6-23)16-10(17)4-3-8(14)13(20)21/h7-9,23H,3-6,14H2,1-2H3,(H,15,19)(H,16,17)(H,20,21)/t8-,9+/m0/s1 | Definition date: | 2020-11-11 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | (2~{S})-2-azanyl-5-oxidanylidene-5-[[(2~{S})-1-oxidanylidene-1-[(2-oxidanylidene-2-propan-2-yloxy-ethyl)amino]-3-sulfanyl-propan-2-yl]amino]pentanoic acid |
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![S8T S8T](https://data.pdbj.org/pdbjplus/data/cc/svg/S8T.svg) | S8T | Name: | 9-fluoranyl-3-propan-2-yl-5,6-dihydrobenzo[b][1]benzothiepine | Formula: | C17 H17 F S | SMILES: | CC(C)c1ccc2Sc3cc(F)ccc3CCc2c1 | InChi: | InChI=1S/C17H17FS/c1-11(2)13-6-8-16-14(9-13)4-3-12-5-7-15(18)10-17(12)19-16/h5-11H,3-4H2,1-2H3 | Synonyms: | Isofloxythepin | Definition date: | 2020-11-11 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | 9-fluoranyl-3-propan-2-yl-5,6-dihydrobenzo[b][1]benzothiepine |
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![WG4 WG4](https://data.pdbj.org/pdbjplus/data/cc/svg/WG4.svg) | WG4 | Name: | N-(5-{[(5S)-7-(5-methylimidazo[1,2-a]pyrimidin-7-yl)-2,7-diazaspiro[4.4]nonan-2-yl]methyl}-1,3-thiazol-2-yl)acetamide | Formula: | C20 H25 N7 O S | SMILES: | CC(=O)Nc1sc(cn1)CN5CCC2(CN(CC2)c4cc(C)n3ccnc3n4)C5 | InChi: | InChI=1S/C20H25N7OS/c1-14-9-17(24-18-21-5-8-27(14)18)26-7-4-20(13-26)3-6-25(12-20)11-16-10-22-19(29-16)23-15(2)28/h5,8-10H,3-4,6-7,11-13H2,1-2H3,(H,22,23,28)/t20-/m0/s1 | Definition date: | 2020-10-28 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | N-(5-{[(5S)-7-(5-methylimidazo[1,2-a]pyrimidin-7-yl)-2,7-diazaspiro[4.4]nonan-2-yl]methyl}-1,3-thiazol-2-yl)acetamide |
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![V4M V4M](https://data.pdbj.org/pdbjplus/data/cc/svg/V4M.svg) | V4M | Name: | 2-(4-chlorophenyl)-N-({2-[(3S)-2,6-dioxopiperidin-3-yl]-1-oxo-2,3-dihydro-1H-isoindol-5-yl}methyl)-2,2-difluoroacetamide | Formula: | C22 H18 Cl F2 N3 O4 | SMILES: | c2cc4C(N(C1CCC(NC1=O)=O)Cc4cc2CNC(C(F)(F)c3ccc(cc3)Cl)=O)=O | InChi: | InChI=1S/C22H18ClF2N3O4/c23-15-4-2-14(3-5-15)22(24,25)21(32)26-10-12-1-6-16-13(9-12)11-28(20(16)31)17-7-8-18(29)27-19(17)30/h1-6,9,17H,7-8,10-11H2,(H,26,32)(H,27,29,30)/t17-/m0/s1 | Definition date: | 2020-06-26 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | 2-(4-chlorophenyl)-N-({2-[(3S)-2,6-dioxopiperidin-3-yl]-1-oxo-2,3-dihydro-1H-isoindol-5-yl}methyl)-2,2-difluoroacetamide |
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![RGW RGW](https://data.pdbj.org/pdbjplus/data/cc/svg/RGW.svg) | RGW | Name: | ~{N}-(1-adamantylmethyl)-2-[(7~{R},9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,10,12-tetraen-9-yl]ethanamide | Formula: | C30 H36 Cl N5 O S | SMILES: | Cc1sc2n3c(C)nnc3[CH](CC(=O)NCC45CC6CC(CC(C6)C4)C5)N[CH](c7ccc(Cl)cc7)c2c1C | InChi: | InChI=1S/C30H36ClN5OS/c1-16-17(2)38-29-26(16)27(22-4-6-23(31)7-5-22)33-24(28-35-34-18(3)36(28)29)11-25(37)32-15-30-12-19-8-20(13-30)10-21(9-19)14-30/h4-7,19-21,24,27,33H,8-15H2,1-3H3,(H,32,37)/t19-,20+,21-,24-,27+,30-/m0/s1 | Definition date: | 2020-09-29 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | ~{N}-(1-adamantylmethyl)-2-[(7~{R},9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,10,12-tetraen-9-yl]ethanamide |
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![RVW RVW](https://data.pdbj.org/pdbjplus/data/cc/svg/RVW.svg) | RVW | Name: | (2~{S},3~{R},4~{R},5~{S},6~{S})-2-(hydroxymethyl)-6-sulfanyl-oxane-3,4,5-triol | Formula: | C6 H12 O5 S | SMILES: | OC[CH]1O[CH](S)[CH](O)[CH](O)[CH]1O | InChi: | InChI=1S/C6H12O5S/c7-1-2-3(8)4(9)5(10)6(12)11-2/h2-10,12H,1H2/t2-,3-,4+,5-,6-/m0/s1 | Synonyms: | thioglucose | Definition date: | 2020-10-25 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | (2~{S},3~{R},4~{R},5~{S},6~{S})-2-(hydroxymethyl)-6-sulfanyl-oxane-3,4,5-triol |
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![X1A X1A](https://data.pdbj.org/pdbjplus/data/cc/svg/X1A.svg) | X1A | Name: | N-(5-{[6-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-2,6-diazaspiro[3.4]octan-2-yl]methyl}-1,3-thiazol-2-yl)acetamide | Formula: | C18 H22 N8 O S | SMILES: | C(Nc1sc(cn1)CN2CC5(C2)CN(c3n4c(nc(c3)C)ncn4)CC5)(=O)C | InChi: | InChI=1S/C18H22N8OS/c1-12-5-15(26-16(22-12)20-11-21-26)25-4-3-18(10-25)8-24(9-18)7-14-6-19-17(28-14)23-13(2)27/h5-6,11H,3-4,7-10H2,1-2H3,(H,19,23,27) | Definition date: | 2020-11-20 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | N-(5-{[6-(5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-2,6-diazaspiro[3.4]octan-2-yl]methyl}-1,3-thiazol-2-yl)acetamide |
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![QQD QQD](https://data.pdbj.org/pdbjplus/data/cc/svg/QQD.svg) | QQD | Name: | 4-{[(2S)-3,3-dimethyl-2-(pyridin-3-yl)-2,3-dihydro-1H-indol-1-yl]methyl}-N-hydroxybenzamide | Formula: | C23 H23 N3 O2 | SMILES: | c1ncccc1C4C(C)(c2ccccc2N4Cc3ccc(cc3)C(NO)=O)C | InChi: | InChI=1S/C23H23N3O2/c1-23(2)19-7-3-4-8-20(19)26(21(23)18-6-5-13-24-14-18)15-16-9-11-17(12-10-16)22(27)25-28/h3-14,21,28H,15H2,1-2H3,(H,25,27)/t21-/m1/s1 | Definition date: | 2019-12-09 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | 4-{[(2S)-3,3-dimethyl-2-(pyridin-3-yl)-2,3-dihydro-1H-indol-1-yl]methyl}-N-hydroxybenzamide |
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![QQG QQG](https://data.pdbj.org/pdbjplus/data/cc/svg/QQG.svg) | QQG | Name: | N-hydroxy-4-[(1-methyl-1,2-dihydro-1'H-spiro[indole-3,4'-piperidin]-1'-yl)methyl]benzamide | Formula: | C21 H25 N3 O2 | SMILES: | C4C1(c2c(N(C1)C)cccc2)CCN(Cc3ccc(cc3)C(NO)=O)C4 | InChi: | InChI=1S/C21H25N3O2/c1-23-15-21(18-4-2-3-5-19(18)23)10-12-24(13-11-21)14-16-6-8-17(9-7-16)20(25)22-26/h2-9,26H,10-15H2,1H3,(H,22,25) | Definition date: | 2019-12-09 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | N-hydroxy-4-[(1-methyl-1,2-dihydro-1'H-spiro[indole-3,4'-piperidin]-1'-yl)methyl]benzamide |
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![R6Q R6Q](https://data.pdbj.org/pdbjplus/data/cc/svg/R6Q.svg) | R6Q | Name: | 1'-[2-[4-(trifluoromethyl)phenyl]ethyl]spiro[1~{H}-3,1-benzoxazine-4,4'-piperidine]-2-one | Formula: | C21 H21 F3 N2 O2 | SMILES: | FC(F)(F)c1ccc(CCN2CCC3(CC2)OC(=O)Nc4ccccc34)cc1 | InChi: | InChI=1S/C21H21F3N2O2/c22-21(23,24)16-7-5-15(6-8-16)9-12-26-13-10-20(11-14-26)17-3-1-2-4-18(17)25-19(27)28-20/h1-8H,9-14H2,(H,25,27) | Definition date: | 2020-09-10 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | 1'-[2-[4-(trifluoromethyl)phenyl]ethyl]spiro[1~{H}-3,1-benzoxazine-4,4'-piperidine]-2-one |
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![X3P X3P](https://data.pdbj.org/pdbjplus/data/cc/svg/X3P.svg) | X3P | Name: | [(2~{R})-1-octanoyloxy-3-[oxidanyl-[2-(trimethyl-$l^{4}-azanyl)ethoxy]phosphoryl]oxy-propan-2-yl] nonanoate | Formula: | C25 H51 N O8 P | SMILES: | CCCCCCCCC(=O)O[CH](COC(=O)CCCCCCC)CO[P](O)(=O)OCC[N](C)(C)C | InChi: | InChI=1S/C25H51NO8P/c1-6-8-10-12-14-16-18-25(28)34-23(21-31-24(27)17-15-13-11-9-7-2)22-33-35(29,30)32-20-19-26(3,4)5/h23H,6-22H2,1-5H3,(H,29,30)/t23-/m1/s1 | Definition date: | 2020-11-24 | Last modified: | 2020-11-27 | Release date: | 2020-12-02 | Identifier: | [(2~{R})-1-octanoyloxy-3-[oxidanyl-[2-(trimethyl-$l^{4}-azanyl)ethoxy]phosphoryl]oxy-propan-2-yl] nonanoate |
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