![8Q8 8Q8](https://data.pdbj.org/pdbjplus/data/cc/svg/8Q8.svg) | 8Q8 | Name: | (2~{S})-3-azanyl-2-[[(1~{R})-5-[2-[4-[[2-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]ethynyl]-2,3-dihydro-1~{H}-inden-1-yl]amino]-3-methyl-~{N}-oxidanyl-butanamide | Formula: | C27 H31 N5 O3 | SMILES: | CC(C)(N)[CH](N[CH]1CCc2cc(ccc12)C#Cc3ccc(Cn4ccnc4CO)cc3)C(=O)NO | InChi: | InChI=1S/C27H31N5O3/c1-27(2,28)25(26(34)31-35)30-23-12-10-21-15-19(9-11-22(21)23)6-3-18-4-7-20(8-5-18)16-32-14-13-29-24(32)17-33/h4-5,7-9,11,13-15,23,25,30,33,35H,10,12,16-17,28H2,1-2H3,(H,31,34)/t23-,25-/m1/s1 | Definition date: | 2017-02-23 | Last modified: | 2017-03-24 | Release date: | 2017-03-29 | Identifier: | (2~{S})-3-azanyl-2-[[(1~{R})-5-[2-[4-[[2-(hydroxymethyl)imidazol-1-yl]methyl]phenyl]ethynyl]-2,3-dihydro-1~{H}-inden-1-yl]amino]-3-methyl-~{N}-oxidanyl-butanamide |
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![8R4 8R4](https://data.pdbj.org/pdbjplus/data/cc/svg/8R4.svg) | 8R4 | Name: | 2-cyclopentyl-4-(5-phenylfuro[2,3-b]pyridin-3-yl)benzoic acid | Formula: | C25 H21 N O3 | SMILES: | c1(c(C(O)=O)ccc(c1)c2coc3ncc(cc23)c4ccccc4)C5CCCC5 | InChi: | InChI=1S/C25H21NO3/c27-25(28)20-11-10-18(12-21(20)17-8-4-5-9-17)23-15-29-24-22(23)13-19(14-26-24)16-6-2-1-3-7-16/h1-3,6-7,10-15,17H,4-5,8-9H2,(H,27,28) | Definition date: | 2017-03-03 | Last modified: | 2017-03-24 | Release date: | 2017-03-29 | Identifier: | 2-cyclopentyl-4-(5-phenylfuro[2,3-b]pyridin-3-yl)benzoic acid |
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![FIG FIG](https://data.pdbj.org/pdbjplus/data/cc/svg/FIG.svg) | FIG | Name: | 6-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-1,6-dihydropyrimidine-5-carboxylic acid | Formula: | C13 H10 N2 O4 S | SMILES: | C(SC1=NC=C(C(O)=O)C(N1)=O)C(=O)c2ccccc2 | InChi: | InChI=1S/C13H10N2O4S/c16-10(8-4-2-1-3-5-8)7-20-13-14-6-9(12(18)19)11(17)15-13/h1-6H,7H2,(H,18,19)(H,14,15,17) | Definition date: | 2016-03-17 | Last modified: | 2017-03-24 | Release date: | 2017-03-29 | Identifier: | 6-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-1,6-dihydropyrimidine-5-carboxylic acid |
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![UGI UGI](https://data.pdbj.org/pdbjplus/data/cc/svg/UGI.svg) | UGI | Name: | 5-(6-morpholin-4-yl-2-pyrrolidin-1-yl-pyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine | Formula: | C18 H21 F3 N6 O | SMILES: | Nc1cc(c(cn1)c2cc(nc(n2)N3CCCC3)N4CCOCC4)C(F)(F)F | InChi: | InChI=1S/C18H21F3N6O/c19-18(20,21)13-9-15(22)23-11-12(13)14-10-16(26-5-7-28-8-6-26)25-17(24-14)27-3-1-2-4-27/h9-11H,1-8H2,(H2,22,23) | Definition date: | 2016-10-31 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | 5-(6-morpholin-4-yl-2-pyrrolidin-1-yl-pyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine |
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![QVR QVR](https://data.pdbj.org/pdbjplus/data/cc/svg/QVR.svg) | QVR | Name: | (2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[(~{E})-prop-1-enyl]oxolane-3,4-diol | Formula: | C12 H15 N5 O3 | SMILES: | CC=C[CH]1O[CH]([CH](O)[CH]1O)n2cnc3c(N)ncnc23 | InChi: | InChI=1S/C12H15N5O3/c1-2-3-6-8(18)9(19)12(20-6)17-5-16-7-10(13)14-4-15-11(7)17/h2-6,8-9,12,18-19H,1H3,(H2,13,14,15)/b3-2+/t6-,8-,9-,12-/m1/s1 | Definition date: | 2016-12-22 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | (2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[(~{E})-prop-1-enyl]oxolane-3,4-diol |
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![RPQ RPQ](https://data.pdbj.org/pdbjplus/data/cc/svg/RPQ.svg) | RPQ | Name: | D-rhamnopyranose tetrazole | Formula: | C6 H10 N4 O3 | SMILES: | C[CH]1[CH](O)[CH](O)[CH](O)c2nnnn12 | InChi: | InChI=1S/C6H10N4O3/c1-2-3(11)4(12)5(13)6-7-8-9-10(2)6/h2-5,11-13H,1H3/t2-,3-,4+,5+/m0/s1 | Definition date: | 2016-12-20 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | (5~{S},6~{S},7~{R},8~{S})-5-methyl-5,6,7,8-tetrahydro-[1,2,3,4]tetrazolo[1,5-a]pyridine-6,7,8-triol |
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![82M 82M](https://data.pdbj.org/pdbjplus/data/cc/svg/82M.svg) | 82M | Name: | N-{(1S)-2-amino-1-[5-(hydroxymethyl)-4-methyl-1,3-thiazol-2-yl]ethyl}-5-(4-chloro-3-fluorophenyl)-1H-pyrrole-2-carboxamide | Formula: | C18 H18 Cl F N4 O2 S | SMILES: | C(C(NC(=O)c1nc(cc1)c2cc(F)c(Cl)cc2)c3sc(c(C)n3)CO)N | InChi: | InChI=1S/C18H18ClFN4O2S/c1-9-16(8-25)27-18(22-9)15(7-21)24-17(26)14-5-4-13(23-14)10-2-3-11(19)12(20)6-10/h2-6,15,23,25H,7-8,21H2,1H3,(H,24,26)/t15-/m0/s1 | Definition date: | 2016-12-16 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | N-{(1S)-2-amino-1-[5-(hydroxymethyl)-4-methyl-1,3-thiazol-2-yl]ethyl}-5-(4-chloro-3-fluorophenyl)-1H-pyrrole-2-carboxamide |
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![8AM 8AM](https://data.pdbj.org/pdbjplus/data/cc/svg/8AM.svg) | 8AM | Name: | N-[(3R,4R)-4-fluoro-1-{6-[(3-methoxy-1-methyl-1H-pyrazol-4-yl)amino]-9-(propan-2-yl)-9H-purin-2-yl}pyrrolidin-3-yl]propanamide | Formula: | C20 H28 F N9 O2 | SMILES: | C1C(NC(=O)CC)C(CN1c3nc(Nc2cn(C)nc2OC)c4c(n3)n(cn4)C(C)C)F | InChi: | InChI=1S/C20H28FN9O2/c1-6-15(31)23-13-9-29(7-12(13)21)20-25-17(24-14-8-28(4)27-19(14)32-5)16-18(26-20)30(10-22-16)11(2)3/h8,10-13H,6-7,9H2,1-5H3,(H,23,31)(H,24,25,26)/t12-,13-/m1/s1 | Definition date: | 2017-01-17 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | N-[(3R,4R)-4-fluoro-1-{6-[(3-methoxy-1-methyl-1H-pyrazol-4-yl)amino]-9-(propan-2-yl)-9H-purin-2-yl}pyrrolidin-3-yl]propanamide |
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![8B4 8B4](https://data.pdbj.org/pdbjplus/data/cc/svg/8B4.svg) | 8B4 | Name: | (1S)-1-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-1,4-anhydro-2-deoxy-2-fluoro-5-O-[(S)-hydroxy(phosphonooxy)phosphoryl]-2-methyl-D-ribitol | Formula: | C11 H16 F N5 O9 P2 | SMILES: | c2nc1c(ncnn1c2C3C(F)(C)C(O)C(O3)COP(OP(O)(O)=O)(O)=O)N | InChi: | InChI=1S/C11H16FN5O9P2/c1-11(12)7(18)6(3-24-28(22,23)26-27(19,20)21)25-8(11)5-2-14-10-9(13)15-4-16-17(5)10/h2,4,6-8,18H,3H2,1H3,(H,22,23)(H2,13,15,16)(H2,19,20,21)/t6-,7-,8+,11-/m1/s1 | Definition date: | 2017-01-17 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | (1S)-1-(4-aminoimidazo[2,1-f][1,2,4]triazin-7-yl)-1,4-anhydro-2-deoxy-2-fluoro-5-O-[(S)-hydroxy(phosphonooxy)phosphoryl]-2-methyl-D-ribitol |
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![8BP 8BP](https://data.pdbj.org/pdbjplus/data/cc/svg/8BP.svg) | 8BP | Name: | N-[(3R,4R)-4-fluoro-1-{6-[(1-methyl-1H-pyrazol-4-yl)amino]-9-(propan-2-yl)-9H-purin-2-yl}pyrrolidin-3-yl]propanamide | Formula: | C19 H26 F N9 O | SMILES: | C1C(NC(CC)=O)C(CN1c3nc(Nc2cn(C)nc2)c4c(n3)n(cn4)C(C)C)F | InChi: | InChI=1S/C19H26FN9O/c1-5-15(30)24-14-9-28(8-13(14)20)19-25-17(23-12-6-22-27(4)7-12)16-18(26-19)29(10-21-16)11(2)3/h6-7,10-11,13-14H,5,8-9H2,1-4H3,(H,24,30)(H,23,25,26)/t13-,14-/m1/s1 | Definition date: | 2017-01-17 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | N-[(3R,4R)-4-fluoro-1-{6-[(1-methyl-1H-pyrazol-4-yl)amino]-9-(propan-2-yl)-9H-purin-2-yl}pyrrolidin-3-yl]propanamide |
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![8BS 8BS](https://data.pdbj.org/pdbjplus/data/cc/svg/8BS.svg) | 8BS | Name: | N-[(3R,4R)-4-fluoro-1-{6-[(3-methoxy-1-methyl-1H-pyrazol-4-yl)amino]-9-methyl-9H-purin-2-yl}pyrrolidin-3-yl]propanamide | Formula: | C18 H24 F N9 O2 | SMILES: | C1C(NC(CC)=O)C(CN1c3nc(Nc2cn(C)nc2OC)c4c(n3)n(cn4)C)F | InChi: | InChI=1S/C18H24FN9O2/c1-5-13(29)21-11-8-28(6-10(11)19)18-23-15(14-16(24-18)26(2)9-20-14)22-12-7-27(3)25-17(12)30-4/h7,9-11H,5-6,8H2,1-4H3,(H,21,29)(H,22,23,24)/t10-,11-/m1/s1 | Definition date: | 2017-01-17 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | N-[(3R,4R)-4-fluoro-1-{6-[(3-methoxy-1-methyl-1H-pyrazol-4-yl)amino]-9-methyl-9H-purin-2-yl}pyrrolidin-3-yl]propanamide |
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![5JJ 5JJ](https://data.pdbj.org/pdbjplus/data/cc/svg/5JJ.svg) | 5JJ | Name: | N~6~-(2,6-dichlorophenyl)-N~6~-(pent-2-yn-1-yl)quinoline-4,6-diamine | Formula: | C20 H17 Cl2 N3 | SMILES: | c1cc(N)c2c(n1)ccc(c2)N(c3c(Cl)cccc3Cl)CC#CCC | InChi: | InChI=1S/C20H17Cl2N3/c1-2-3-4-12-25(20-16(21)6-5-7-17(20)22)14-8-9-19-15(13-14)18(23)10-11-24-19/h5-11,13H,2,12H2,1H3,(H2,23,24) | Definition date: | 2015-10-02 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | N~6~-(2,6-dichlorophenyl)-N~6~-(pent-2-yn-1-yl)quinoline-4,6-diamine |
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![5JT 5JT](https://data.pdbj.org/pdbjplus/data/cc/svg/5JT.svg) | 5JT | Name: | (3R)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-amine | Formula: | C11 H15 N5 | SMILES: | c2nc3c(c(N1CC(CCC1)N)n2)ccn3 | InChi: | InChI=1S/C11H15N5/c12-8-2-1-5-16(6-8)11-9-3-4-13-10(9)14-7-15-11/h3-4,7-8H,1-2,5-6,12H2,(H,13,14,15)/t8-/m1/s1 | Definition date: | 2015-10-05 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | (3R)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-amine |
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![5JU 5JU](https://data.pdbj.org/pdbjplus/data/cc/svg/5JU.svg) | 5JU | Name: | N~2~-{[2-chloro-3-(2-methylpyridin-3-yl)-1-benzothiophen-5-yl]carbamoyl}-N-(3-{methyl[(3R)-1-(5H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-yl]amino}propyl)glycinamide | Formula: | C32 H36 Cl N9 O2 S | SMILES: | c6(c(c5c4cc(NC(=O)NCC(NCCCN(C)C3CCCN(c2c1CC=Nc1ncn2)C3)=O)ccc4sc5Cl)cccn6)C | InChi: | InChI=1S/C32H36ClN9O2S/c1-20-23(7-3-11-34-20)28-25-16-21(8-9-26(25)45-29(28)33)40-32(44)37-17-27(43)35-12-5-14-41(2)22-6-4-15-42(18-22)31-24-10-13-36-30(24)38-19-39-31/h3,7-9,11,13,16,19,22H,4-6,10,12,14-15,17-18H2,1-2H3,(H,35,43)(H2,37,40,44)/t22-/m1/s1 | Definition date: | 2015-10-05 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | N~2~-{[2-chloro-3-(2-methylpyridin-3-yl)-1-benzothiophen-5-yl]carbamoyl}-N-(3-{methyl[(3R)-1-(5H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-yl]amino}propyl)glycinamide |
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![6ZR 6ZR](https://data.pdbj.org/pdbjplus/data/cc/svg/6ZR.svg) | 6ZR | Name: | (3R,4R)-4-(4-methoxy-3-oxidanyl-phenyl)-3-methyl-1-(3,4,5-trimethoxyphenyl)azetidin-2-one | Formula: | C20 H23 N O6 | SMILES: | COc1ccc(cc1O)[CH]2[CH](C)C(=O)N2c3cc(OC)c(OC)c(OC)c3 | InChi: | InChI=1S/C20H23NO6/c1-11-18(12-6-7-15(24-2)14(22)8-12)21(20(11)23)13-9-16(25-3)19(27-5)17(10-13)26-4/h6-11,18,22H,1-5H3/t11-,18-/m1/s1 | Definition date: | 2016-08-02 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | (3~{R},4~{R})-4-(4-methoxy-3-oxidanyl-phenyl)-3-methyl-1-(3,4,5-trimethoxyphenyl)azetidin-2-one |
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![7SM 7SM](https://data.pdbj.org/pdbjplus/data/cc/svg/7SM.svg) | 7SM | Name: | 6-(2-{[cyclopropyl(3'-methoxy[1,1'-biphenyl]-4-carbonyl)amino]methyl}phenoxy)hexanoic acid | Formula: | C30 H33 N O5 | SMILES: | c4c(CN(C1CC1)C(c3ccc(c2cccc(c2)OC)cc3)=O)c(OCCCCCC(=O)O)ccc4 | InChi: | InChI=1S/C30H33NO5/c1-35-27-10-7-9-24(20-27)22-13-15-23(16-14-22)30(34)31(26-17-18-26)21-25-8-4-5-11-28(25)36-19-6-2-3-12-29(32)33/h4-5,7-11,13-16,20,26H,2-3,6,12,17-19,21H2,1H3,(H,32,33) | Definition date: | 2016-12-05 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | 6-(2-{[cyclopropyl(3'-methoxy[1,1'-biphenyl]-4-carbonyl)amino]methyl}phenoxy)hexanoic acid |
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![7SS 7SS](https://data.pdbj.org/pdbjplus/data/cc/svg/7SS.svg) | 7SS | Name: | 6-(2-{[cyclopropyl(4'-methoxy[1,1'-biphenyl]-4-carbonyl)amino]methyl}phenoxy)hexanoic acid | Formula: | C30 H33 N O5 | SMILES: | c4c(CN(C1CC1)C(c2ccc(cc2)c3ccc(cc3)OC)=O)c(ccc4)OCCCCCC(O)=O | InChi: | InChI=1S/C30H33NO5/c1-35-27-18-14-23(15-19-27)22-10-12-24(13-11-22)30(34)31(26-16-17-26)21-25-7-4-5-8-28(25)36-20-6-2-3-9-29(32)33/h4-5,7-8,10-15,18-19,26H,2-3,6,9,16-17,20-21H2,1H3,(H,32,33) | Definition date: | 2016-12-05 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | 6-(2-{[cyclopropyl(4'-methoxy[1,1'-biphenyl]-4-carbonyl)amino]methyl}phenoxy)hexanoic acid |
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![7SV 7SV](https://data.pdbj.org/pdbjplus/data/cc/svg/7SV.svg) | 7SV | Name: | 6-(2-{[cyclopropyl(2'-fluoro[1,1'-biphenyl]-4-carbonyl)amino]methyl}phenoxy)hexanoic acid | Formula: | C29 H30 F N O4 | SMILES: | c4(c(CN(C(c1ccc(cc1)c2ccccc2F)=O)C3CC3)cccc4)OCCCCCC(=O)O | InChi: | InChI=1S/C29H30FNO4/c30-26-10-5-4-9-25(26)21-13-15-22(16-14-21)29(34)31(24-17-18-24)20-23-8-3-6-11-27(23)35-19-7-1-2-12-28(32)33/h3-6,8-11,13-16,24H,1-2,7,12,17-20H2,(H,32,33) | Definition date: | 2016-12-05 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | 6-(2-{[cyclopropyl(2'-fluoro[1,1'-biphenyl]-4-carbonyl)amino]methyl}phenoxy)hexanoic acid |
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![7SY 7SY](https://data.pdbj.org/pdbjplus/data/cc/svg/7SY.svg) | 7SY | Name: | 6-(2-{[cyclopropyl(3'-fluoro[1,1'-biphenyl]-4-carbonyl)amino]methyl}phenoxy)hexanoic acid | Formula: | C29 H30 F N O4 | SMILES: | c4c(CN(C1CC1)C(c3ccc(c2cc(F)ccc2)cc3)=O)c(ccc4)OCCCCCC(O)=O | InChi: | InChI=1S/C29H30FNO4/c30-25-9-6-8-23(19-25)21-12-14-22(15-13-21)29(34)31(26-16-17-26)20-24-7-3-4-10-27(24)35-18-5-1-2-11-28(32)33/h3-4,6-10,12-15,19,26H,1-2,5,11,16-18,20H2,(H,32,33) | Definition date: | 2016-12-05 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | 6-(2-{[cyclopropyl(3'-fluoro[1,1'-biphenyl]-4-carbonyl)amino]methyl}phenoxy)hexanoic acid |
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![7T1 7T1](https://data.pdbj.org/pdbjplus/data/cc/svg/7T1.svg) | 7T1 | Name: | {2-methyl-4-[({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}methyl)sulfanyl]phenoxy}acetic acid | Formula: | C21 H18 F3 N O3 S2 | SMILES: | c1cc(C(F)(F)F)ccc1c2sc(c(n2)C)CSc3cc(C)c(cc3)OCC(=O)O | InChi: | InChI=1S/C21H18F3NO3S2/c1-12-9-16(7-8-17(12)28-10-19(26)27)29-11-18-13(2)25-20(30-18)14-3-5-15(6-4-14)21(22,23)24/h3-9H,10-11H2,1-2H3,(H,26,27) | Definition date: | 2016-12-05 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | {2-methyl-4-[({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}methyl)sulfanyl]phenoxy}acetic acid |
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![7TS 7TS](https://data.pdbj.org/pdbjplus/data/cc/svg/7TS.svg) | 7TS | Name: | (5-hydroxy-6-methyl-4-{[(3-oxo-2,3-dihydro-1,2-oxazol-4-yl)amino]methyl}pyridin-3-yl)methyl dihydrogen phosphate | Formula: | C11 H14 N3 O7 P | SMILES: | n2c(C)c(O)c(CNC=1C(=O)NOC=1)c(c2)COP(O)(O)=O | InChi: | InChI=1S/C11H14N3O7P/c1-6-10(15)8(3-13-9-5-20-14-11(9)16)7(2-12-6)4-21-22(17,18)19/h2,5,13,15H,3-4H2,1H3,(H,14,16)(H2,17,18,19) | Definition date: | 2016-12-06 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | (5-hydroxy-6-methyl-4-{[(3-oxo-2,3-dihydro-1,2-oxazol-4-yl)amino]methyl}pyridin-3-yl)methyl dihydrogen phosphate |
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![7TV 7TV](https://data.pdbj.org/pdbjplus/data/cc/svg/7TV.svg) | 7TV | Name: | 6-[2-({cyclopentyl[4-(furan-2-yl)benzene-1-carbonyl]amino}methyl)phenoxy]hexanoic acid | Formula: | C29 H33 N O5 | SMILES: | c4c(CN(C1CCCC1)C(c2ccc(cc2)c3occc3)=O)c(OCCCCCC(=O)O)ccc4 | InChi: | InChI=1S/C29H33NO5/c31-28(32)14-2-1-7-19-34-27-12-6-3-9-24(27)21-30(25-10-4-5-11-25)29(33)23-17-15-22(16-18-23)26-13-8-20-35-26/h3,6,8-9,12-13,15-18,20,25H,1-2,4-5,7,10-11,14,19,21H2,(H,31,32) | Definition date: | 2016-12-06 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | 6-[2-({cyclopentyl[4-(furan-2-yl)benzene-1-carbonyl]amino}methyl)phenoxy]hexanoic acid |
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![7TY 7TY](https://data.pdbj.org/pdbjplus/data/cc/svg/7TY.svg) | 7TY | Name: | 6-[2-({cyclopentyl[4-(furan-3-yl)benzene-1-carbonyl]amino}methyl)phenoxy]hexanoic acid | Formula: | C29 H33 N O5 | SMILES: | c1c(c(ccc1)OCCCCCC(O)=O)CN(C2CCCC2)C(c4ccc(c3cocc3)cc4)=O | InChi: | InChI=1S/C29H33NO5/c31-28(32)12-2-1-7-18-35-27-11-6-3-8-24(27)20-30(26-9-4-5-10-26)29(33)23-15-13-22(14-16-23)25-17-19-34-21-25/h3,6,8,11,13-17,19,21,26H,1-2,4-5,7,9-10,12,18,20H2,(H,31,32) | Definition date: | 2016-12-06 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | 6-[2-({cyclopentyl[4-(furan-3-yl)benzene-1-carbonyl]amino}methyl)phenoxy]hexanoic acid |
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![7U1 7U1](https://data.pdbj.org/pdbjplus/data/cc/svg/7U1.svg) | 7U1 | Name: | 6-(2-{[([1,1'-biphenyl]-4-carbonyl)(cyclopropyl)amino]methyl}phenoxy)hexanoic acid | Formula: | C29 H31 N O4 | SMILES: | c1cccc(c1CN(C2CC2)C(c3ccc(cc3)c4ccccc4)=O)OCCCCCC(O)=O | InChi: | InChI=1S/C29H31NO4/c31-28(32)13-5-2-8-20-34-27-12-7-6-11-25(27)21-30(26-18-19-26)29(33)24-16-14-23(15-17-24)22-9-3-1-4-10-22/h1,3-4,6-7,9-12,14-17,26H,2,5,8,13,18-21H2,(H,31,32) | Definition date: | 2016-12-06 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | 6-(2-{[([1,1'-biphenyl]-4-carbonyl)(cyclopropyl)amino]methyl}phenoxy)hexanoic acid |
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![7U4 7U4](https://data.pdbj.org/pdbjplus/data/cc/svg/7U4.svg) | 7U4 | Name: | 6-[2-({cyclopropyl[4-(pyridin-3-yl)benzene-1-carbonyl]amino}methyl)phenoxy]hexanoic acid | Formula: | C28 H30 N2 O4 | SMILES: | n4cccc(c1ccc(cc1)C(N(Cc2ccccc2OCCCCCC(O)=O)C3CC3)=O)c4 | InChi: | InChI=1S/C28H30N2O4/c31-27(32)10-2-1-5-18-34-26-9-4-3-7-24(26)20-30(25-15-16-25)28(33)22-13-11-21(12-14-22)23-8-6-17-29-19-23/h3-4,6-9,11-14,17,19,25H,1-2,5,10,15-16,18,20H2,(H,31,32) | Definition date: | 2016-12-06 | Last modified: | 2017-03-17 | Release date: | 2017-03-22 | Identifier: | 6-[2-({cyclopropyl[4-(pyridin-3-yl)benzene-1-carbonyl]amino}methyl)phenoxy]hexanoic acid |
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