![2N2 2N2](https://data.pdbj.org/pdbjplus/data/cc/svg/2N2.svg) | 2N2 | Name: | 2-(3,6-dihydroxy-9H-xanthen-9-yl)-5-{[(6-oxohexyl)carbamothioyl]amino}benzoic acid | Formula: | C27 H26 N2 O7 S | SMILES: | O=CCCCCCNC(=S)Nc1ccc(c(C(=O)O)c1)C3c4c(Oc2c3ccc(O)c2)cc(O)cc4 | InChi: | InChI=1S/C27H26N2O7S/c30-16-6-9-19-22(13-16)36-23-14-17(31)7-10-20(23)25(19)18-8-5-15(12-21(18)26(34)35)29-27(37)28-11-3-1-2-4-24(32)33/h5-10,12-14,25,30-31H,1-4,11H2,(H,32,33)(H,34,35)(H2,28,29,37) | Definition date: | 2013-12-05 | Last modified: | 2024-06-28 | Release date: | 2014-02-26 | Identifier: | 2-(3,6-dihydroxy-9H-xanthen-9-yl)-5-{[(6-oxohexyl)carbamothioyl]amino}benzoic acid |
|
![O6H O6H](https://data.pdbj.org/pdbjplus/data/cc/svg/O6H.svg) | O6H | Name: | 2,4,6-trimethyl-L-phenylalanine | Formula: | C12 H17 N O2 | SMILES: | Cc1cc(C)c(C[CH](N)C(O)=O)c(C)c1 | InChi: | InChI=1S/C12H17NO2/c1-7-4-8(2)10(9(3)5-7)6-11(13)12(14)15/h4-5,11H,6,13H2,1-3H3,(H,14,15)/t11-/m0/s1 | Synonyms: | (2~{S})-2-azanyl-3-(2,4,6-trimethylphenyl)propanal | Definition date: | 2020-02-13 | Last modified: | 2024-06-28 | Release date: | 2021-01-27 | Identifier: | (2~{S})-2-azanyl-3-(2,4,6-trimethylphenyl)propanoic acid |
|
![P5R P5R](https://data.pdbj.org/pdbjplus/data/cc/svg/P5R.svg) | P5R | Name: | 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol | Formula: | C34 H70 O18 | SMILES: | OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO | InChi: | InChI=1S/C34H70O18/c35-1-3-37-5-7-39-9-11-41-13-15-43-17-19-45-21-23-47-25-27-49-29-31-51-33-34-52-32-30-50-28-26-48-24-22-46-20-18-44-16-14-42-12-10-40-8-6-38-4-2-36/h35-36H,1-34H2 | Definition date: | 2023-08-22 | Last modified: | 2024-06-28 | Release date: | 2024-07-03 | Identifier: | 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
|
![P8R P8R](https://data.pdbj.org/pdbjplus/data/cc/svg/P8R.svg) | P8R | Name: | 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethane | Formula: | C24 H50 O12 | SMILES: | COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC | InChi: | InChI=1S/C24H50O12/c1-25-3-5-27-7-9-29-11-13-31-15-17-33-19-21-35-23-24-36-22-20-34-18-16-32-14-12-30-10-8-28-6-4-26-2/h3-24H2,1-2H3 | Definition date: | 2023-08-24 | Last modified: | 2024-06-28 | Release date: | 2024-07-03 | Identifier: | 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethane |
|
![4M9 4M9](https://data.pdbj.org/pdbjplus/data/cc/svg/4M9.svg) | 4M9 | Name: | (4Z)-4-imino-4-[(4Z)-4-(1H-indol-3-ylmethylidene)-5-oxo-1-(2-oxoethyl)-4,5-dihydro-1H-imidazol-2-yl]butanamide | Formula: | C18 H17 N5 O4 | SMILES: | O=C1/C(N=C(N1CC=O)/C(CCC(=O)N)=N)=C/c2cnc3ccccc23 | InChi: | InChI=1S/C18H17N5O4/c19-12(5-6-15(20)24)17-22-14(18(27)23(17)9-16(25)26)7-10-8-21-13-4-2-1-3-11(10)13/h1-4,7-8,19,21H,5-6,9H2,(H2,20,24)(H,25,26)/b14-7-,19-12+ | Synonyms: | CHROMOPHORE (GLN-TRP-GLY) | Definition date: | 2015-04-15 | Last modified: | 2024-06-28 | Release date: | 2015-12-23 | Identifier: | (4Z)-4-imino-4-[(4Z)-4-(1H-indol-3-ylmethylidene)-5-oxo-1-(2-oxoethyl)-4,5-dihydro-1H-imidazol-2-yl]butanamide |
|
![TUK TUK](https://data.pdbj.org/pdbjplus/data/cc/svg/TUK.svg) | TUK | Name: | 2-[2-[(1~{S})-1-azanyl-3-methylsulfanyl-propyl]-4-(1~{H}-indol-3-ylmethyl)-5-oxidanylidene-2~{H}-imidazol-1-yl]ethanal | Formula: | C18 H22 N4 O3 S | SMILES: | CSCC[CH](N)[CH]1N=C(Cc2c[nH]c3ccccc23)C(=O)N1CC(O)=O | InChi: | InChI=1S/C18H22N4O3S/c1-26-7-6-13(19)17-21-15(18(25)22(17)10-16(23)24)8-11-9-20-14-5-3-2-4-12(11)14/h2-5,9,13,17,20H,6-8,10,19H2,1H3,(H,23,24)/t13-,17-/m0/s1 | Definition date: | 2021-01-13 | Last modified: | 2024-06-28 | Release date: | 2022-03-02 | Identifier: | 2-[2-[(1~{S})-1-azanyl-3-methylsulfanyl-propyl]-4-(1~{H}-indol-3-ylmethyl)-5-oxidanylidene-2~{H}-imidazol-1-yl]ethanoic acid |
|
![C12 C12](https://data.pdbj.org/pdbjplus/data/cc/svg/C12.svg) | C12 | Name: | 2-(1-AMINO-2-HYDROXYPROPYL)-4-(4-HYDROXYBENZYL)-1-(2-OXOETHYL)-1H-IMIDAZOL-5-OLATE | Formula: | C15 H18 N3 O5 | SMILES: | [O-]c1c(nc(n1CC=O)C(N)C(O)C)Cc2ccc(O)cc2 | InChi: | InChI=1S/C15H19N3O5/c1-8(19)13(16)14-17-11(15(23)18(14)7-12(21)22)6-9-2-4-10(20)5-3-9/h2-5,8,13,19-20,23H,6-7,16H2,1H3,(H,21,22)/p-1/t8-,13+/m1/s1 | Synonyms: | PEPTIDE DERIVED CHROMOPHORE | Definition date: | 2006-02-23 | Last modified: | 2024-06-28 | Identifier: | 2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-(4-hydroxybenzyl)-1-(2-oxoethyl)-1H-imidazol-5-olate |
|
![V00 V00](https://data.pdbj.org/pdbjplus/data/cc/svg/V00.svg) | V00 | Name: | ~{N}-[(3-fluorophenyl)methyl]-1-[(1~{R})-1-(3-methoxynaphthalen-1-yl)ethyl]piperidine-4-carboxamide | Formula: | C26 H29 F N2 O2 | SMILES: | COc1cc2ccccc2c(c1)[CH](C)N3CCC(CC3)C(=O)NCc4cccc(F)c4 | InChi: | InChI=1S/C26H29FN2O2/c1-18(25-16-23(31-2)15-21-7-3-4-9-24(21)25)29-12-10-20(11-13-29)26(30)28-17-19-6-5-8-22(27)14-19/h3-9,14-16,18,20H,10-13,17H2,1-2H3,(H,28,30)/t18-/m1/s1 | Definition date: | 2023-06-30 | Last modified: | 2024-06-28 | Release date: | 2024-07-03 | Identifier: | ~{N}-[(3-fluorophenyl)methyl]-1-[(1~{R})-1-(3-methoxynaphthalen-1-yl)ethyl]piperidine-4-carboxamide |
|
![V7P V7P](https://data.pdbj.org/pdbjplus/data/cc/svg/V7P.svg) | V7P | Name: | (2S)-2-amino-3-(6-fluoroquinolin-4-yl)propanal | Formula: | C12 H11 F N2 O2 | SMILES: | c2(F)ccc1c(c(ccn1)CC(C=O)N)c2 | InChi: | InChI=1S/C12H11FN2O2/c13-8-1-2-11-9(6-8)7(3-4-15-11)5-10(14)12(16)17/h1-4,6,10H,5,14H2,(H,16,17)/t10-/m0/s1 | Definition date: | 2020-07-13 | Last modified: | 2024-06-28 | Release date: | 2020-11-18 | Identifier: | (2S)-2-amino-3-(6-fluoroquinolin-4-yl)propanal |
|
![01W 01W](https://data.pdbj.org/pdbjplus/data/cc/svg/01W.svg) | 01W | Name: | (2S)-2-ammonio-4-[(2,4-dinitrophenyl)amino]butanoate | Formula: | C10 H12 N4 O6 | SMILES: | [O-][N+](=O)c1ccc(NCCC(C([O-])=O)[NH3+])c(c1)[N+]([O-])=O | InChi: | InChI=1S/C10H12N4O6/c11-7(10(15)16)3-4-12-8-2-1-6(13(17)18)5-9(8)14(19)20/h1-2,5,7,12H,3-4,11H2,(H,15,16)/t7-/m0/s1 | Definition date: | 2008-07-21 | Last modified: | 2024-06-26 | Identifier: | (2S)-2-ammonio-4-[(2,4-dinitrophenyl)amino]butanoate |
|
![AJO AJO](https://data.pdbj.org/pdbjplus/data/cc/svg/AJO.svg) | AJO | Name: | 2-[cyanomethyl(methyl)amino]-N-(6-methylpyridin-2-yl)ethanamide | Formula: | C11 H14 N4 O | SMILES: | CN(CC#N)CC(=O)Nc1cccc(C)n1 | InChi: | InChI=1S/C11H14N4O/c1-9-4-3-5-10(13-9)14-11(16)8-15(2)7-6-12/h3-5H,7-8H2,1-2H3,(H,13,14,16) | Definition date: | 2021-11-09 | Last modified: | 2024-06-26 | Release date: | 2024-06-19 | Identifier: | 2-[cyanomethyl(methyl)amino]-~{N}-(6-methylpyridin-2-yl)ethanamide |
|
![YMW YMW](https://data.pdbj.org/pdbjplus/data/cc/svg/YMW.svg) | YMW | Name: | 7-chloranyl-2-ethyl-5-pyridin-3-yl-pyrazolo[3,4-c]quinolin-4-one | Formula: | C17 H13 Cl N4 O | SMILES: | CCn1cc2c3ccc(Cl)cc3N(C(=O)c2n1)c4cccnc4 | InChi: | InChI=1S/C17H13ClN4O/c1-2-21-10-14-13-6-5-11(18)8-15(13)22(17(23)16(14)20-21)12-4-3-7-19-9-12/h3-10H,2H2,1H3 | Definition date: | 2023-12-06 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | 7-chloranyl-2-ethyl-5-pyridin-3-yl-pyrazolo[3,4-c]quinolin-4-one |
|
![YN8 YN8](https://data.pdbj.org/pdbjplus/data/cc/svg/YN8.svg) | YN8 | Name: | 7-chloranyl-5-(2-cyclopropylpyridin-3-yl)-8-fluoranyl-2-methyl-pyrazolo[3,4-c]quinolin-4-one | Formula: | C19 H14 Cl F N4 O | SMILES: | Cn1cc2c3cc(F)c(Cl)cc3N(C(=O)c2n1)c4cccnc4C5CC5 | InChi: | InChI=1S/C19H14ClFN4O/c1-24-9-12-11-7-14(21)13(20)8-16(11)25(19(26)18(12)23-24)15-3-2-6-22-17(15)10-4-5-10/h2-3,6-10H,4-5H2,1H3 | Definition date: | 2023-12-06 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | 7-chloranyl-5-(2-cyclopropylpyridin-3-yl)-8-fluoranyl-2-methyl-pyrazolo[3,4-c]quinolin-4-one |
|
![ZRF ZRF](https://data.pdbj.org/pdbjplus/data/cc/svg/ZRF.svg) | ZRF | Name: | 2-[(4E)-2-[(1S)-1-aminoethyl]-4-(hydroxymethylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid | Formula: | C8 H11 N3 O4 | SMILES: | C[CH](N)C1=NC(=CO)C(=O)N1CC(O)=O | InChi: | InChI=1S/C8H11N3O4/c1-4(9)7-10-5(3-12)8(15)11(7)2-6(13)14/h3-4,12H,2,9H2,1H3,(H,13,14)/b5-3+/t4-/m0/s1 | Synonyms: | 2-[(4~{E})-2-(1-azanylethyl)-5-oxidanylidene-4-(oxidanylmethylidene)imidazol-1-yl]ethanoic acid | Definition date: | 2024-01-22 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | 2-[(4~{E})-2-(1-azanylethyl)-5-oxidanylidene-4-(oxidanylmethylidene)imidazol-1-yl]ethanoic acid |
|
![ZRH ZRH](https://data.pdbj.org/pdbjplus/data/cc/svg/ZRH.svg) | ZRH | Name: | (2S)-1-(3-amino-6-fluoro-1H-indazol-1-yl)-2-methyl-3-phenoxypropan-1-one | Formula: | C17 H16 F N3 O2 | SMILES: | CC(COc1ccccc1)C(=O)n1nc(N)c2ccc(F)cc21 | InChi: | InChI=1S/C17H16FN3O2/c1-11(10-23-13-5-3-2-4-6-13)17(22)21-15-9-12(18)7-8-14(15)16(19)20-21/h2-9,11H,10H2,1H3,(H2,19,20)/t11-/m0/s1 | Definition date: | 2023-03-24 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | (2S)-1-(3-amino-6-fluoro-1H-indazol-1-yl)-2-methyl-3-phenoxypropan-1-one |
|
![WFQ WFQ](https://data.pdbj.org/pdbjplus/data/cc/svg/WFQ.svg) | WFQ | Name: | (4S)-2-[(1R,4s)-1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl]-N-[(8S)-6-methylpyrazolo[1,5-a]pyrimidin-3-yl]-7-[(propan-2-yl)oxy]imidazo[1,2-a]pyrimidine-6-carboxamide | Formula: | C23 H25 N7 O3 | SMILES: | Cc1cn2ncc(NC(=O)c3cn4cc(nc4nc3OC(C)C)C34CC(C)(C3)OC4)c2nc1 | InChi: | InChI=1S/C23H25N7O3/c1-13(2)33-20-15(19(31)26-16-6-25-30-7-14(3)5-24-18(16)30)8-29-9-17(27-21(29)28-20)23-10-22(4,11-23)32-12-23/h5-9,13H,10-12H2,1-4H3,(H,26,31)/t22-,23- | Definition date: | 2023-10-02 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | (4S)-2-[(1R,4s)-1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl]-N-[(8S)-6-methylpyrazolo[1,5-a]pyrimidin-3-yl]-7-[(propan-2-yl)oxy]imidazo[1,2-a]pyrimidine-6-carboxamide |
|
![WP9 WP9](https://data.pdbj.org/pdbjplus/data/cc/svg/WP9.svg) | WP9 | Name: | ~{S}-[2-[3-[[(2~{R})-4-[[(2~{S})-2-azanyl-3-oxidanylidene-propoxy]-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethyl] 2-azanylbenzenecarbothioate | Formula: | C21 H33 N4 O9 P S | SMILES: | CC(C)(CO[P](O)(=O)OC[CH](N)C=O)[CH](O)C(=O)NCCC(=O)NCCSC(=O)c1ccccc1N | InChi: | InChI=1S/C21H33N4O9PS/c1-21(2,13-34-35(31,32)33-12-14(22)11-26)18(28)19(29)25-8-7-17(27)24-9-10-36-20(30)15-5-3-4-6-16(15)23/h3-6,11,14,18,28H,7-10,12-13,22-23H2,1-2H3,(H,24,27)(H,25,29)(H,31,32)/t14-,18+/m1/s1 | Definition date: | 2023-10-10 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | ~{S}-[2-[3-[[(2~{R})-4-[[(2~{S})-2-azanyl-3-oxidanylidene-propoxy]-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethyl] 2-azanylbenzenecarbothioate |
|
![WRZ WRZ](https://data.pdbj.org/pdbjplus/data/cc/svg/WRZ.svg) | WRZ | Name: | N-[(2,4-dichlorophenyl)methyl]-4-propanamidobenzamide | Formula: | C17 H16 Cl2 N2 O2 | SMILES: | Clc1cc(Cl)ccc1CNC(=O)c1ccc(NC(=O)CC)cc1 | InChi: | InChI=1S/C17H16Cl2N2O2/c1-2-16(22)21-14-7-4-11(5-8-14)17(23)20-10-12-3-6-13(18)9-15(12)19/h3-9H,2,10H2,1H3,(H,20,23)(H,21,22) | Definition date: | 2023-10-10 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | N-[(2,4-dichlorophenyl)methyl]-4-propanamidobenzamide |
|
![WUU WUU](https://data.pdbj.org/pdbjplus/data/cc/svg/WUU.svg) | WUU | Name: | N-[(2,4-dichlorophenyl)methyl]-4-(2,5-dioxopyrrolidin-1-yl)benzamide | Formula: | C18 H14 Cl2 N2 O3 | SMILES: | Clc1ccc(CNC(=O)c2ccc(cc2)N2C(=O)CCC2=O)c(Cl)c1 | InChi: | InChI=1S/C18H14Cl2N2O3/c19-13-4-1-12(15(20)9-13)10-21-18(25)11-2-5-14(6-3-11)22-16(23)7-8-17(22)24/h1-6,9H,7-8,10H2,(H,21,25) | Definition date: | 2023-10-13 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | N-[(2,4-dichlorophenyl)methyl]-4-(2,5-dioxopyrrolidin-1-yl)benzamide |
|
![WUZ WUZ](https://data.pdbj.org/pdbjplus/data/cc/svg/WUZ.svg) | WUZ | Name: | N-[(2,4-dichlorophenyl)methyl]-4-[(3R)-3-methyl-2,5-dioxopyrrolidin-1-yl]benzamide | Formula: | C19 H16 Cl2 N2 O3 | SMILES: | Clc1ccc(CNC(=O)c2ccc(cc2)N2C(=O)CC(C)C2=O)c(Cl)c1 | InChi: | InChI=1S/C19H16Cl2N2O3/c1-11-8-17(24)23(19(11)26)15-6-3-12(4-7-15)18(25)22-10-13-2-5-14(20)9-16(13)21/h2-7,9,11H,8,10H2,1H3,(H,22,25)/t11-/m1/s1 | Definition date: | 2023-10-13 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | N-[(2,4-dichlorophenyl)methyl]-4-[(3R)-3-methyl-2,5-dioxopyrrolidin-1-yl]benzamide |
|
![X1T X1T](https://data.pdbj.org/pdbjplus/data/cc/svg/X1T.svg) | X1T | Name: | 6-(difluoromethyl)-N-[(4R)-7-ethoxy-2-{[(3R)-oxolan-3-yl]methyl}imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide | Formula: | C21 H22 F2 N4 O3 | SMILES: | FC(F)c1cccc(n1)C(=O)Nc1cn2cc(nc2cc1OCC)CC1CCOC1 | InChi: | InChI=1S/C21H22F2N4O3/c1-2-30-18-9-19-24-14(8-13-6-7-29-12-13)10-27(19)11-17(18)26-21(28)16-5-3-4-15(25-16)20(22)23/h3-5,9-11,13,20H,2,6-8,12H2,1H3,(H,26,28)/t13-/m0/s1 | Definition date: | 2023-10-19 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | 6-(difluoromethyl)-N-[(4R)-7-ethoxy-2-{[(3R)-oxolan-3-yl]methyl}imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide |
|
![X6U X6U](https://data.pdbj.org/pdbjplus/data/cc/svg/X6U.svg) | X6U | Name: | 3-[3-cyano-4-(methylsulfonylmethyl)phenyl]-7-propan-2-yl-1~{H}-indole-2-carboxylic acid | Formula: | C21 H20 N2 O4 S | SMILES: | CC(C)c1cccc2c1[nH]c(C(O)=O)c2c3ccc(C[S](C)(=O)=O)c(c3)C#N | InChi: | InChI=1S/C21H20N2O4S/c1-12(2)16-5-4-6-17-18(20(21(24)25)23-19(16)17)13-7-8-14(11-28(3,26)27)15(9-13)10-22/h4-9,12,23H,11H2,1-3H3,(H,24,25) | Definition date: | 2023-06-05 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | 3-[3-cyano-4-(methylsulfonylmethyl)phenyl]-7-propan-2-yl-1~{H}-indole-2-carboxylic acid |
|
![X78 X78](https://data.pdbj.org/pdbjplus/data/cc/svg/X78.svg) | X78 | Name: | 3-(2-acetamido-1,3-benzothiazol-7-yl)-7-propan-2-yl-1~{H}-indole-2-carboxylic acid | Formula: | C21 H19 N3 O3 S | SMILES: | CC(C)c1cccc2c1[nH]c(C(O)=O)c2c3cccc4nc(NC(C)=O)sc34 | InChi: | InChI=1S/C21H19N3O3S/c1-10(2)12-6-4-7-13-16(18(20(26)27)24-17(12)13)14-8-5-9-15-19(14)28-21(23-15)22-11(3)25/h4-10,24H,1-3H3,(H,26,27)(H,22,23,25) | Definition date: | 2023-06-05 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | 3-(2-acetamido-1,3-benzothiazol-7-yl)-7-propan-2-yl-1~{H}-indole-2-carboxylic acid |
|
![XA9 XA9](https://data.pdbj.org/pdbjplus/data/cc/svg/XA9.svg) | XA9 | Name: | 3-(2-ethoxypyridin-3-yl)-7-propan-2-yl-1~{H}-indole-2-carboxylic acid | Formula: | C19 H20 N2 O3 | SMILES: | CCOc1ncccc1c2c([nH]c3c(cccc23)C(C)C)C(O)=O | InChi: | InChI=1S/C19H20N2O3/c1-4-24-18-14(9-6-10-20-18)15-13-8-5-7-12(11(2)3)16(13)21-17(15)19(22)23/h5-11,21H,4H2,1-3H3,(H,22,23) | Definition date: | 2023-06-06 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | 3-(2-ethoxypyridin-3-yl)-7-propan-2-yl-1~{H}-indole-2-carboxylic acid |
|
![XAQ XAQ](https://data.pdbj.org/pdbjplus/data/cc/svg/XAQ.svg) | XAQ | Name: | 3-[3-fluoranyl-4-[(piperidin-4-ylsulfonylamino)methyl]phenyl]-7-propan-2-yl-1~{H}-indole-2-carboxylic acid | Formula: | C24 H28 F N3 O4 S | SMILES: | CC(C)c1cccc2c1[nH]c(C(O)=O)c2c3ccc(CN[S](=O)(=O)C4CCNCC4)c(F)c3 | InChi: | InChI=1S/C24H28FN3O4S/c1-14(2)18-4-3-5-19-21(23(24(29)30)28-22(18)19)15-6-7-16(20(25)12-15)13-27-33(31,32)17-8-10-26-11-9-17/h3-7,12,14,17,26-28H,8-11,13H2,1-2H3,(H,29,30) | Definition date: | 2023-06-06 | Last modified: | 2024-06-21 | Release date: | 2024-06-26 | Identifier: | 3-[3-fluoranyl-4-[(piperidin-4-ylsulfonylamino)methyl]phenyl]-7-propan-2-yl-1~{H}-indole-2-carboxylic acid |
|