![ZRR ZRR](https://data.pdbj.org/pdbjplus/data/cc/svg/ZRR.svg) | ZRR | Name: | (5P)-3-({(8R)-5-[(4-aminopiperidin-1-yl)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}amino)-5-[2-(propan-2-yl)-2H-tetrazol-5-yl]phenol | Formula: | C22 H28 N10 O | SMILES: | CC(C)n1nc(nn1)c1cc(O)cc(Nc2ncnn3ccc(CN4CCC(N)CC4)c32)c1 | InChi: | InChI=1S/C22H28N10O/c1-14(2)32-28-21(27-29-32)16-9-18(11-19(33)10-16)26-22-20-15(3-8-31(20)25-13-24-22)12-30-6-4-17(23)5-7-30/h3,8-11,13-14,17,33H,4-7,12,23H2,1-2H3,(H,24,25,26) | Definition date: | 2023-03-27 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | (5P)-3-({(8R)-5-[(4-aminopiperidin-1-yl)methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl}amino)-5-[2-(propan-2-yl)-2H-tetrazol-5-yl]phenol |
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![Z9I Z9I](https://data.pdbj.org/pdbjplus/data/cc/svg/Z9I.svg) | Z9I | Name: | 1-[(2R)-1-(methanesulfonyl)pyrrolidin-2-yl]methanamine | Formula: | C6 H14 N2 O2 S | SMILES: | NCC1CCCN1S(=O)(C)=O | InChi: | InChI=1S/C6H14N2O2S/c1-11(9,10)8-4-2-3-6(8)5-7/h6H,2-5,7H2,1H3/t6-/m1/s1 | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 1-[(2R)-1-(methanesulfonyl)pyrrolidin-2-yl]methanamine |
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![ZA9 ZA9](https://data.pdbj.org/pdbjplus/data/cc/svg/ZA9.svg) | ZA9 | Name: | 4-[(3S)-piperidin-3-yl]-1H-indole | Formula: | C13 H16 N2 | SMILES: | c1c[NH]c2cccc(c12)C1CCCNC1 | InChi: | InChI=1S/C13H16N2/c1-4-11(10-3-2-7-14-9-10)12-6-8-15-13(12)5-1/h1,4-6,8,10,14-15H,2-3,7,9H2/t10-/m1/s1 | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 4-[(3S)-piperidin-3-yl]-1H-indole |
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![ZT7 ZT7](https://data.pdbj.org/pdbjplus/data/cc/svg/ZT7.svg) | ZT7 | Name: | 1-(5-amino-2H-isoindol-2-yl)ethan-1-one | Formula: | C10 H10 N2 O | SMILES: | CC(=O)n1cc2ccc(N)cc2c1 | InChi: | InChI=1S/C10H10N2O/c1-7(13)12-5-8-2-3-10(11)4-9(8)6-12/h2-6H,11H2,1H3 | Definition date: | 2023-07-03 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 1-(5-amino-2H-isoindol-2-yl)ethan-1-one |
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![ZBH ZBH](https://data.pdbj.org/pdbjplus/data/cc/svg/ZBH.svg) | ZBH | Name: | (4S)-N,2-dimethyl-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide | Formula: | C10 H14 N2 O S | SMILES: | CNC(=O)C1CCCc2sc(C)nc21 | InChi: | InChI=1S/C10H14N2OS/c1-6-12-9-7(10(13)11-2)4-3-5-8(9)14-6/h7H,3-5H2,1-2H3,(H,11,13)/t7-/m0/s1 | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | (4S)-N,2-dimethyl-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide |
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![ZC9 ZC9](https://data.pdbj.org/pdbjplus/data/cc/svg/ZC9.svg) | ZC9 | Name: | (2P)-5-fluoro-2-(1H-pyrazol-5-yl)pyridine | Formula: | C8 H6 F N3 | SMILES: | Fc1cnc(cc1)c1ccn[NH]1 | InChi: | InChI=1S/C8H6FN3/c9-6-1-2-7(10-5-6)8-3-4-11-12-8/h1-5H,(H,11,12) | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | (2P)-5-fluoro-2-(1H-pyrazol-5-yl)pyridine |
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![ZCI ZCI](https://data.pdbj.org/pdbjplus/data/cc/svg/ZCI.svg) | ZCI | Name: | 2-bromo-1H-imidazole | Formula: | C3 H3 Br N2 | SMILES: | Brc1ncc[NH]1 | InChi: | InChI=1S/C3H3BrN2/c4-3-5-1-2-6-3/h1-2H,(H,5,6) | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 2-bromo-1H-imidazole |
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![ZDL ZDL](https://data.pdbj.org/pdbjplus/data/cc/svg/ZDL.svg) | ZDL | Name: | 1,3-dimethylimidazolidine | Formula: | C5 H12 N2 | SMILES: | CN1CCN(C)C1 | InChi: | InChI=1S/C5H12N2/c1-6-3-4-7(2)5-6/h3-5H2,1-2H3 | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 1,3-dimethylimidazolidine |
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![ZE9 ZE9](https://data.pdbj.org/pdbjplus/data/cc/svg/ZE9.svg) | ZE9 | Name: | 1-[(3R,5R)-5-(furan-2-yl)-3-(5-methylfuran-2-yl)pyrazolidin-1-yl]ethan-1-one | Formula: | C14 H16 N2 O3 | SMILES: | CC(=O)N1NC(CC1c1ccco1)c1ccc(C)o1 | InChi: | InChI=1S/C14H16N2O3/c1-9-5-6-13(19-9)11-8-12(14-4-3-7-18-14)16(15-11)10(2)17/h3-7,11-12,15H,8H2,1-2H3/t11-,12-/m1/s1 | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 1-[(3R,5R)-5-(furan-2-yl)-3-(5-methylfuran-2-yl)pyrazolidin-1-yl]ethan-1-one |
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![ZEK ZEK](https://data.pdbj.org/pdbjplus/data/cc/svg/ZEK.svg) | ZEK | Name: | 3-acetamido-N-methylbenzamide | Formula: | C10 H12 N2 O2 | SMILES: | O=C(C)Nc1cc(ccc1)C(=O)NC | InChi: | InChI=1S/C10H12N2O2/c1-7(13)12-9-5-3-4-8(6-9)10(14)11-2/h3-6H,1-2H3,(H,11,14)(H,12,13) | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 3-acetamido-N-methylbenzamide |
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![ZFI ZFI](https://data.pdbj.org/pdbjplus/data/cc/svg/ZFI.svg) | ZFI | Name: | N-[2-(methanesulfonyl)phenyl]acetamide | Formula: | C9 H11 N O3 S | SMILES: | O=S(C)(=O)c1ccccc1NC(C)=O | InChi: | InChI=1S/C9H11NO3S/c1-7(11)10-8-5-3-4-6-9(8)14(2,12)13/h3-6H,1-2H3,(H,10,11) | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | N-[2-(methanesulfonyl)phenyl]acetamide |
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![ZG0 ZG0](https://data.pdbj.org/pdbjplus/data/cc/svg/ZG0.svg) | ZG0 | Name: | N-(3-methylphenyl)acetamide | Formula: | C9 H11 N O | SMILES: | O=C(C)Nc1cc(C)ccc1 | InChi: | InChI=1S/C9H11NO/c1-7-4-3-5-9(6-7)10-8(2)11/h3-6H,1-2H3,(H,10,11) | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | N-(3-methylphenyl)acetamide |
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![ZG6 ZG6](https://data.pdbj.org/pdbjplus/data/cc/svg/ZG6.svg) | ZG6 | Name: | N-(3-methyl-1,2-oxazol-5-yl)acetamide | Formula: | C6 H8 N2 O2 | SMILES: | O=C(C)Nc1cc(C)no1 | InChi: | InChI=1S/C6H8N2O2/c1-4-3-6(10-8-4)7-5(2)9/h3H,1-2H3,(H,7,9) | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | N-(3-methyl-1,2-oxazol-5-yl)acetamide |
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![ZGF ZGF](https://data.pdbj.org/pdbjplus/data/cc/svg/ZGF.svg) | ZGF | Name: | N-(6-chloro-2H-1,3-benzodioxol-5-yl)acetamide | Formula: | C9 H8 Cl N O3 | SMILES: | CC(=O)Nc1cc2OCOc2cc1Cl | InChi: | InChI=1S/C9H8ClNO3/c1-5(12)11-7-3-9-8(2-6(7)10)13-4-14-9/h2-3H,4H2,1H3,(H,11,12) | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | N-(6-chloro-2H-1,3-benzodioxol-5-yl)acetamide |
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![ZGI ZGI](https://data.pdbj.org/pdbjplus/data/cc/svg/ZGI.svg) | ZGI | Name: | (1R,2S,5S)-N-{(2S)-1-(1,3-benzothiazol-2-yl)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-3-[N-(tert-butylcarbamoyl)-3-methyl-L-valyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide | Formula: | C33 H46 N6 O5 S | SMILES: | CC(C)(C)NC(=O)NC(C(=O)N1CC2C(C1C(=O)NC(CC1CCNC1=O)C(=O)c1nc3ccccc3s1)C2(C)C)C(C)(C)C | InChi: | InChI=1S/C33H46N6O5S/c1-31(2,3)25(37-30(44)38-32(4,5)6)29(43)39-16-18-22(33(18,7)8)23(39)27(42)35-20(15-17-13-14-34-26(17)41)24(40)28-36-19-11-9-10-12-21(19)45-28/h9-12,17-18,20,22-23,25H,13-16H2,1-8H3,(H,34,41)(H,35,42)(H2,37,38,44)/t17-,18-,20-,22-,23-,25+/m0/s1 | Definition date: | 2023-03-09 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | (1R,2S,5S)-N-{(2S)-1-(1,3-benzothiazol-2-yl)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-3-[N-(tert-butylcarbamoyl)-3-methyl-L-valyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide |
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![ZGK ZGK](https://data.pdbj.org/pdbjplus/data/cc/svg/ZGK.svg) | ZGK | Name: | N-(2-methoxyphenyl)acetamide | Formula: | C9 H11 N O2 | SMILES: | COc1ccccc1NC(C)=O | InChi: | InChI=1S/C9H11NO2/c1-7(11)10-8-5-3-4-6-9(8)12-2/h3-6H,1-2H3,(H,10,11) | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | N-(2-methoxyphenyl)acetamide |
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![ZGO ZGO](https://data.pdbj.org/pdbjplus/data/cc/svg/ZGO.svg) | ZGO | Name: | (1R,2S,5S)-N-{(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl}-6,6-dimethyl-3-[3-methyl-N-({1-[(2-methylpropane-2-sulfonyl)methyl]cyclohexyl}carbamoyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide | Formula: | C33 H54 N6 O6 S | SMILES: | CC1(C)C2C(C(=O)NC(C#N)CC3CCNC3=O)N(CC21)C(=O)C(NC(=O)NC1(CS(=O)(=O)C(C)(C)C)CCCCC1)C(C)(C)C | InChi: | InChI=1S/C33H54N6O6S/c1-30(2,3)25(37-29(43)38-33(13-10-9-11-14-33)19-46(44,45)31(4,5)6)28(42)39-18-22-23(32(22,7)8)24(39)27(41)36-21(17-34)16-20-12-15-35-26(20)40/h20-25H,9-16,18-19H2,1-8H3,(H,35,40)(H,36,41)(H2,37,38,43)/t20-,21-,22-,23-,24-,25+/m0/s1 | Definition date: | 2023-03-09 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | (1R,2S,5S)-N-{(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl}-6,6-dimethyl-3-[3-methyl-N-({1-[(2-methylpropane-2-sulfonyl)methyl]cyclohexyl}carbamoyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide |
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![ZGQ ZGQ](https://data.pdbj.org/pdbjplus/data/cc/svg/ZGQ.svg) | ZGQ | Name: | N-[(2-methylphenyl)methyl]acetamide | Formula: | C10 H13 N O | SMILES: | CC(=O)NCc1ccccc1C | InChi: | InChI=1S/C10H13NO/c1-8-5-3-4-6-10(8)7-11-9(2)12/h3-6H,7H2,1-2H3,(H,11,12) | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | N-[(2-methylphenyl)methyl]acetamide |
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![ZGW ZGW](https://data.pdbj.org/pdbjplus/data/cc/svg/ZGW.svg) | ZGW | Name: | Nirmatrelvir | Formula: | C23 H32 F3 N5 O4 | SMILES: | CC1(C)C2C(C(=O)NC(C#N)CC3CCNC3=O)N(CC21)C(=O)C(NC(=O)C(F)(F)F)C(C)(C)C | InChi: | InChI=1S/C23H32F3N5O4/c1-21(2,3)16(30-20(35)23(24,25)26)19(34)31-10-13-14(22(13,4)5)15(31)18(33)29-12(9-27)8-11-6-7-28-17(11)32/h11-16H,6-8,10H2,1-5H3,(H,28,32)(H,29,33)(H,30,35)/t11-,12-,13-,14-,15-,16+/m0/s1 | Synonyms: | (1R,2S,5S)-N-{(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide | Definition date: | 2023-03-09 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | (1R,2S,5S)-N-{(1S)-1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide |
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![ZGX ZGX](https://data.pdbj.org/pdbjplus/data/cc/svg/ZGX.svg) | ZGX | Name: | 1-(3,4-dihydropyrazin-1(2H)-yl)ethan-1-one | Formula: | C6 H10 N2 O | SMILES: | CC(=O)N1C=CNCC1 | InChi: | InChI=1S/C6H10N2O/c1-6(9)8-4-2-7-3-5-8/h2,4,7H,3,5H2,1H3 | Definition date: | 2023-06-23 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 1-(3,4-dihydropyrazin-1(2H)-yl)ethan-1-one |
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![ZH0 ZH0](https://data.pdbj.org/pdbjplus/data/cc/svg/ZH0.svg) | ZH0 | Name: | N~2~-[(benzyloxy)carbonyl]-N-{(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-leucinamide | Formula: | C21 H29 N3 O5 | SMILES: | CC(C)CC(NC(=O)OCc1ccccc1)C(=O)NC(CC1CCNC1=O)C=O | InChi: | InChI=1S/C21H29N3O5/c1-14(2)10-18(24-21(28)29-13-15-6-4-3-5-7-15)20(27)23-17(12-25)11-16-8-9-22-19(16)26/h3-7,12,14,16-18H,8-11,13H2,1-2H3,(H,22,26)(H,23,27)(H,24,28)/t16-,17-,18-/m0/s1 | Definition date: | 2023-03-09 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | N~2~-[(benzyloxy)carbonyl]-N-{(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-leucinamide |
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![YGI YGI](https://data.pdbj.org/pdbjplus/data/cc/svg/YGI.svg) | YGI | Name: | {[(4S)-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetic acid | Formula: | C11 H10 N4 O2 S2 | SMILES: | O=C(O)CSc1nnc2n1cnc1sc(C)c(C)c21 | InChi: | InChI=1S/C11H10N4O2S2/c1-5-6(2)19-10-8(5)9-13-14-11(15(9)4-12-10)18-3-7(16)17/h4H,3H2,1-2H3,(H,16,17) | Definition date: | 2023-06-14 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | {[(4S)-8,9-dimethylthieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetic acid |
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![YW6 YW6](https://data.pdbj.org/pdbjplus/data/cc/svg/YW6.svg) | YW6 | Name: | 2-(furan-3-yl)ethanoic acid | Formula: | C6 H6 O3 | SMILES: | OC(=O)Cc1cocc1 | InChi: | InChI=1S/C6H6O3/c7-6(8)3-5-1-2-9-4-5/h1-2,4H,3H2,(H,7,8) | Definition date: | 2023-06-21 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 2-(furan-3-yl)ethanoic acid |
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![YWX YWX](https://data.pdbj.org/pdbjplus/data/cc/svg/YWX.svg) | YWX | Name: | 2-{3-[(Z)-iminomethyl]-1H-1,2,4-triazol-1-yl}-1-{(3M)-3-[2-(trifluoromethyl)phenyl]-6H-pyrrolo[3,4-b]pyridin-6-yl}ethan-1-one | Formula: | C19 H13 F3 N6 O | SMILES: | O=C(Cn1cnc(C=N)n1)n1cc2cc(cnc2c1)c1ccccc1C(F)(F)F | InChi: | InChI=1S/C19H13F3N6O/c20-19(21,22)15-4-2-1-3-14(15)12-5-13-8-27(9-16(13)24-7-12)18(29)10-28-11-25-17(6-23)26-28/h1-9,11,23H,10H2/b23-6- | Synonyms: | inhibitor CT1, bound form | Definition date: | 2023-03-02 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 2-{3-[(Z)-iminomethyl]-1H-1,2,4-triazol-1-yl}-1-{(3M)-3-[2-(trifluoromethyl)phenyl]-6H-pyrrolo[3,4-b]pyridin-6-yl}ethan-1-one |
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![YX2 YX2](https://data.pdbj.org/pdbjplus/data/cc/svg/YX2.svg) | YX2 | Name: | 3-propanamido-1-benzofuran-2-carboxamide | Formula: | C12 H12 N2 O3 | SMILES: | CCC(=O)Nc1c2ccccc2oc1C(N)=O | InChi: | InChI=1S/C12H12N2O3/c1-2-9(15)14-10-7-5-3-4-6-8(7)17-11(10)12(13)16/h3-6H,2H2,1H3,(H2,13,16)(H,14,15) | Definition date: | 2023-06-22 | Last modified: | 2023-07-07 | Release date: | 2023-07-12 | Identifier: | 3-propanamido-1-benzofuran-2-carboxamide |
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