![73J 73J](https://data.pdbj.org/pdbjplus/data/cc/svg/73J.svg) | 73J | 表記: | ~{N}-[(9~{R})-4-(5-fluoranyl-1~{H}-benzimidazol-2-yl)-9~{H}-fluoren-9-yl]-1~{H}-pyrrolo[2,3-b]pyridine-4-carboxamide | 組成式: | C28 H18 F N5 O | SMILES: | Fc1ccc2[nH]c(nc2c1)c3cccc4[CH](NC(=O)c5ccnc6[nH]ccc56)c7ccccc7c34 | InChi: | InChI=1S/C28H18FN5O/c29-15-8-9-22-23(14-15)33-27(32-22)21-7-3-6-20-24(21)16-4-1-2-5-17(16)25(20)34-28(35)19-11-13-31-26-18(19)10-12-30-26/h1-14,25H,(H,30,31)(H,32,33)(H,34,35)/t25-/m1/s1 | 定義日: | 2016-08-19 | 最終更新日: | 2017-08-18 | 公開日: | 2017-08-23 | 識別子(ID): | ~{N}-[(9~{R})-4-(5-fluoranyl-1~{H}-benzimidazol-2-yl)-9~{H}-fluoren-9-yl]-1~{H}-pyrrolo[2,3-b]pyridine-4-carboxamide |
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![7VA 7VA](https://data.pdbj.org/pdbjplus/data/cc/svg/7VA.svg) | 7VA | 表記: | (5S)-5-({4-[(6-methoxy-1-methyl-1H-benzimidazol-2-yl)methoxy]phenyl}methyl)-1,3-thiazolidine-2,4-dione | 組成式: | C20 H19 N3 O4 S | SMILES: | c2c(CC1C(NC(S1)=O)=O)ccc(c2)OCc4nc3c(cc(cc3)OC)n4C | InChi: | InChI=1S/C20H19N3O4S/c1-23-16-10-14(26-2)7-8-15(16)21-18(23)11-27-13-5-3-12(4-6-13)9-17-19(24)22-20(25)28-17/h3-8,10,17H,9,11H2,1-2H3,(H,22,24,25) | 定義日: | 2016-12-07 | 最終更新日: | 2017-08-18 | 公開日: | 2017-08-23 | 識別子(ID): | (5S)-5-({4-[(6-methoxy-1-methyl-1H-benzimidazol-2-yl)methoxy]phenyl}methyl)-1,3-thiazolidine-2,4-dione |
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![6YH 6YH](https://data.pdbj.org/pdbjplus/data/cc/svg/6YH.svg) | 6YH | 表記: | 4-[2-(benzimidazol-1-yl)ethanoyl]benzenesulfonamide | 組成式: | C15 H13 N3 O3 S | SMILES: | N[S](=O)(=O)c1ccc(cc1)C(=O)Cn2cnc3ccccc23 | InChi: | InChI=1S/C15H13N3O3S/c16-22(20,21)12-7-5-11(6-8-12)15(19)9-18-10-17-13-3-1-2-4-14(13)18/h1-8,10H,9H2,(H2,16,20,21) | 定義日: | 2016-07-26 | 最終更新日: | 2017-08-11 | 公開日: | 2017-08-16 | 識別子(ID): | 4-[2-(benzimidazol-1-yl)ethanoyl]benzenesulfonamide |
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![6YQ 6YQ](https://data.pdbj.org/pdbjplus/data/cc/svg/6YQ.svg) | 6YQ | 表記: | 4-[2-(benzimidazol-1-yl)ethanoyl]-2-chloranyl-benzenesulfonamide | 組成式: | C15 H12 Cl N3 O3 S | SMILES: | N[S](=O)(=O)c1ccc(cc1Cl)C(=O)Cn2cnc3ccccc23 | InChi: | InChI=1S/C15H12ClN3O3S/c16-11-7-10(5-6-15(11)23(17,21)22)14(20)8-19-9-18-12-3-1-2-4-13(12)19/h1-7,9H,8H2,(H2,17,21,22) | 定義日: | 2016-07-27 | 最終更新日: | 2017-08-11 | 公開日: | 2017-08-16 | 識別子(ID): | 4-[2-(benzimidazol-1-yl)ethanoyl]-2-chloranyl-benzenesulfonamide |
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![80R 80R](https://data.pdbj.org/pdbjplus/data/cc/svg/80R.svg) | 80R | 表記: | 5-[(2-chloranyl-4-nitro-phenyl)amino]-1,3-dihydrobenzimidazol-2-one | 組成式: | C13 H9 Cl N4 O3 | SMILES: | [O-][N+](=O)c1ccc(Nc2ccc3NC(=O)Nc3c2)c(Cl)c1 | InChi: | InChI=1S/C13H9ClN4O3/c14-9-6-8(18(20)21)2-4-10(9)15-7-1-3-11-12(5-7)17-13(19)16-11/h1-6,15H,(H2,16,17,19) | 定義日: | 2017-03-09 | 最終更新日: | 2017-08-11 | 公開日: | 2017-08-16 | 識別子(ID): | 5-[(2-chloranyl-4-nitro-phenyl)amino]-1,3-dihydrobenzimidazol-2-one |
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![A9Y A9Y](https://data.pdbj.org/pdbjplus/data/cc/svg/A9Y.svg) | A9Y | 表記: | (3R)-3-[1-(1H-benzimidazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-2-benzofuran-1(3H)-one | 組成式: | C19 H14 N4 O3 | SMILES: | c1c2c(ccc1)C(OC2=O)c3c(C)nn(c3O)c5nc4ccccc4n5 | InChi: | InChI=1S/C19H14N4O3/c1-10-15(16-11-6-2-3-7-12(11)18(25)26-16)17(24)23(22-10)19-20-13-8-4-5-9-14(13)21-19/h2-9,16,24H,1H3,(H,20,21)/t16-/m1/s1 | 定義日: | 2017-07-13 | 最終更新日: | 2017-08-04 | 公開日: | 2017-08-09 | 識別子(ID): | (3R)-3-[1-(1H-benzimidazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-2-benzofuran-1(3H)-one |
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![6SL 6SL](https://data.pdbj.org/pdbjplus/data/cc/svg/6SL.svg) | 6SL | 表記: | 2-pyridin-3-yl-1~{H}-benzimidazole | 組成式: | C12 H9 N3 | SMILES: | [nH]1c2ccccc2nc1c3cccnc3 | InChi: | InChI=1S/C12H9N3/c1-2-6-11-10(5-1)14-12(15-11)9-4-3-7-13-8-9/h1-8H,(H,14,15) | 定義日: | 2016-06-15 | 最終更新日: | 2017-08-04 | 公開日: | 2017-08-09 | 識別子(ID): | 2-pyridin-3-yl-1~{H}-benzimidazole |
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![OBL OBL](https://data.pdbj.org/pdbjplus/data/cc/svg/OBL.svg) | OBL | 表記: | 5-Methoxybenzimidazolyl-norcobamide | 組成式: | C60 H85 Co N13 O15 P | SMILES: | COc1ccc2n(cnc2c1)[CH]3O[CH](CO)[CH](O[P](O)(=O)OCCNC(=O)CC[C]4(C)[CH](CC(N)=O)[CH]5[N+]6=C4C(=C7[CH](CCC(N)=O)C(C)(C)C8=[N+]7[Co]69[N]%10C(=C(C)C%11=[N+]9C(=C8)[CH](CCC(N)=O)[C]%11(C)CC(N)=O)[CH](CCC(N)=O)[C](C)(CC(N)=O)[C]5%10C)C)[CH]3O | InChi: | InChI=1S/C60H86N13O15P.Co/c1-29-48-33(12-16-42(62)76)56(3,4)40(70-48)24-36-32(11-15-41(61)75)58(6,25-45(65)79)53(69-36)30(2)49-34(13-17-43(63)77)59(7,26-46(66)80)60(8,72-49)54-35(23-44(64)78)57(5,52(29)71-54)19-18-47(81)67-20-21-86-89(83,84)88-51-39(27-74)87-55(50(51)82)73-28-68-37-22-31(85-9)10-14-38(37)73 | 定義日: | 2016-11-07 | 最終更新日: | 2017-07-07 | 公開日: | 2017-07-12 |
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![9KV 9KV](https://data.pdbj.org/pdbjplus/data/cc/svg/9KV.svg) | 9KV | 表記: | (2S)-N,2-dicyclohexyl-2-[2-(5-phenylthiophen-2-yl)-1H-benzimidazol-1-yl]acetamide | 組成式: | C31 H35 N3 O S | SMILES: | n3c6c(n(C(C(=O)NC1CCCCC1)C2CCCCC2)c3c5ccc(c4ccccc4)s5)cccc6 | InChi: | InChI=1S/C31H35N3OS/c35-31(32-24-16-8-3-9-17-24)29(23-14-6-2-7-15-23)34-26-19-11-10-18-25(26)33-30(34)28-21-20-27(36-28)22-12-4-1-5-13-22/h1,4-5,10-13,18-21,23-24,29H,2-3,6-9,14-17H2,(H,32,35)/t29-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-N,2-dicyclohexyl-2-[2-(5-phenylthiophen-2-yl)-1H-benzimidazol-1-yl]acetamide |
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![9KY 9KY](https://data.pdbj.org/pdbjplus/data/cc/svg/9KY.svg) | 9KY | 表記: | (2S)-N,2-dicyclohexyl-2-{2-[4-(hydroxymethyl)phenyl]-1H-benzimidazol-1-yl}acetamide | 組成式: | C28 H35 N3 O2 | SMILES: | n3c5c(n(C(C(NC1CCCCC1)=O)C2CCCCC2)c3c4ccc(cc4)CO)cccc5 | InChi: | InChI=1S/C28H35N3O2/c32-19-20-15-17-22(18-16-20)27-30-24-13-7-8-14-25(24)31(27)26(21-9-3-1-4-10-21)28(33)29-23-11-5-2-6-12-23/h7-8,13-18,21,23,26,32H,1-6,9-12,19H2,(H,29,33)/t26-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-N,2-dicyclohexyl-2-{2-[4-(hydroxymethyl)phenyl]-1H-benzimidazol-1-yl}acetamide |
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![9L4 9L4](https://data.pdbj.org/pdbjplus/data/cc/svg/9L4.svg) | 9L4 | 表記: | 3-chloro-4-({(2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexylacetyl}amino)benzoic acid | 組成式: | C28 H23 Cl2 F2 N3 O3 | SMILES: | n3(C(C(=O)Nc1c(Cl)cc(C(O)=O)cc1)C2CCCCC2)c5cc(c(cc5nc3c4ccc(Cl)cc4)F)F | InChi: | InChI=1S/C28H23Cl2F2N3O3/c29-18-9-6-16(7-10-18)26-33-23-13-20(31)21(32)14-24(23)35(26)25(15-4-2-1-3-5-15)27(36)34-22-11-8-17(28(37)38)12-19(22)30/h6-15,25H,1-5H2,(H,34,36)(H,37,38)/t25-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | 3-chloro-4-({(2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexylacetyl}amino)benzoic acid |
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![9L7 9L7](https://data.pdbj.org/pdbjplus/data/cc/svg/9L7.svg) | 9L7 | 表記: | (2S)-2-{2-[4-(benzenecarbonyl)phenyl]-1H-benzimidazol-1-yl}-N,2-dicyclohexylacetamide | 組成式: | C34 H37 N3 O2 | SMILES: | c6c1c(n(c(n1)c2ccc(cc2)C(=O)c3ccccc3)C(C(NC4CCCCC4)=O)C5CCCCC5)ccc6 | InChi: | InChI=1S/C34H37N3O2/c38-32(25-14-6-2-7-15-25)26-20-22-27(23-21-26)33-36-29-18-10-11-19-30(29)37(33)31(24-12-4-1-5-13-24)34(39)35-28-16-8-3-9-17-28/h2,6-7,10-11,14-15,18-24,28,31H,1,3-5,8-9,12-13,16-17H2,(H,35,39)/t31-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-2-{2-[4-(benzenecarbonyl)phenyl]-1H-benzimidazol-1-yl}-N,2-dicyclohexylacetamide |
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![9LA 9LA](https://data.pdbj.org/pdbjplus/data/cc/svg/9LA.svg) | 9LA | 表記: | 4-{(2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexylethoxy}benzoic acid | 組成式: | C28 H25 Cl F2 N2 O3 | SMILES: | n3(C(C1CCCCC1)COc2ccc(cc2)C(O)=O)c5cc(F)c(cc5nc3c4ccc(cc4)Cl)F | InChi: | InChI=1S/C28H25ClF2N2O3/c29-20-10-6-18(7-11-20)27-32-24-14-22(30)23(31)15-25(24)33(27)26(17-4-2-1-3-5-17)16-36-21-12-8-19(9-13-21)28(34)35/h6-15,17,26H,1-5,16H2,(H,34,35)/t26-/m1/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | 4-{(2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexylethoxy}benzoic acid |
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![9LJ 9LJ](https://data.pdbj.org/pdbjplus/data/cc/svg/9LJ.svg) | 9LJ | 表記: | (2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-N-(2-cyanophenyl)-2-cyclohexylacetamide | 組成式: | C28 H23 Cl F2 N4 O | SMILES: | c5c1c(n(c(n1)c2ccc(cc2)Cl)C(C3CCCCC3)C(=O)Nc4c(C#N)cccc4)cc(c5F)F | InChi: | InChI=1S/C28H23ClF2N4O/c29-20-12-10-18(11-13-20)27-33-24-14-21(30)22(31)15-25(24)35(27)26(17-6-2-1-3-7-17)28(36)34-23-9-5-4-8-19(23)16-32/h4-5,8-15,17,26H,1-3,6-7H2,(H,34,36)/t26-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-N-(2-cyanophenyl)-2-cyclohexylacetamide |
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![9LP 9LP](https://data.pdbj.org/pdbjplus/data/cc/svg/9LP.svg) | 9LP | 表記: | trans-4-({(2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexylacetyl}amino)cyclohexyl hydrogen sulfate | 組成式: | C27 H30 Cl F2 N3 O5 S | SMILES: | C1CCCCC1C(C(=O)NC2CCC(CC2)OS(=O)(O)=O)n4c(nc3c4cc(c(c3)F)F)c5ccc(cc5)Cl | InChi: | InChI=1S/C27H30ClF2N3O5S/c28-18-8-6-17(7-9-18)26-32-23-14-21(29)22(30)15-24(23)33(26)25(16-4-2-1-3-5-16)27(34)31-19-10-12-20(13-11-19)38-39(35,36)37/h6-9,14-16,19-20,25H,1-5,10-13H2,(H,31,34)(H,35,36,37)/t19-,20-,25-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | trans-4-({(2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexylacetyl}amino)cyclohexyl hydrogen sulfate |
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![9LS 9LS](https://data.pdbj.org/pdbjplus/data/cc/svg/9LS.svg) | 9LS | 表記: | (2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexyl-N-(2-fluorophenyl)acetamide | 組成式: | C27 H23 Cl F3 N3 O | SMILES: | n3(C(C(=O)Nc1c(cccc1)F)C2CCCCC2)c5cc(c(cc5nc3c4ccc(cc4)Cl)F)F | InChi: | InChI=1S/C27H23ClF3N3O/c28-18-12-10-17(11-13-18)26-32-23-14-20(30)21(31)15-24(23)34(26)25(16-6-2-1-3-7-16)27(35)33-22-9-5-4-8-19(22)29/h4-5,8-16,25H,1-3,6-7H2,(H,33,35)/t25-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexyl-N-(2-fluorophenyl)acetamide |
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![9LY 9LY](https://data.pdbj.org/pdbjplus/data/cc/svg/9LY.svg) | 9LY | 表記: | (2S)-N,2-dicyclohexyl-2-{5,6-difluoro-2-[6-(1H-pyrazol-1-yl)pyridin-3-yl]-1H-benzimidazol-1-yl}acetamide | 組成式: | C29 H32 F2 N6 O | SMILES: | c6c3c(n(c(c1ccc(nc1)n2nccc2)n3)C(C4CCCCC4)C(=O)NC5CCCCC5)cc(c6F)F | InChi: | InChI=1S/C29H32F2N6O/c30-22-16-24-25(17-23(22)31)37(28(35-24)20-12-13-26(32-18-20)36-15-7-14-33-36)27(19-8-3-1-4-9-19)29(38)34-21-10-5-2-6-11-21/h7,12-19,21,27H,1-6,8-11H2,(H,34,38)/t27-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-N,2-dicyclohexyl-2-{5,6-difluoro-2-[6-(1H-pyrazol-1-yl)pyridin-3-yl]-1H-benzimidazol-1-yl}acetamide |
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![9MD 9MD](https://data.pdbj.org/pdbjplus/data/cc/svg/9MD.svg) | 9MD | 表記: | (2S)-2-[6-chloro-2-(4-chlorophenyl)-5-fluoro-1H-benzimidazol-1-yl]-N-cyclohexyl-2-[(2S)-oxan-2-yl]acetamide | 組成式: | C26 H28 Cl2 F N3 O2 | SMILES: | c5c2c(n(c(c1ccc(cc1)Cl)n2)C(C3CCCCO3)C(=O)NC4CCCCC4)cc(Cl)c5F | InChi: | InChI=1S/C26H28Cl2FN3O2/c27-17-11-9-16(10-12-17)25-31-21-15-20(29)19(28)14-22(21)32(25)24(23-8-4-5-13-34-23)26(33)30-18-6-2-1-3-7-18/h9-12,14-15,18,23-24H,1-8,13H2,(H,30,33)/t23-,24-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-2-[6-chloro-2-(4-chlorophenyl)-5-fluoro-1H-benzimidazol-1-yl]-N-cyclohexyl-2-[(2S)-oxan-2-yl]acetamide |
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![9MM 9MM](https://data.pdbj.org/pdbjplus/data/cc/svg/9MM.svg) | 9MM | 表記: | 4-{(2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexylethoxy}-3-fluorobenzoic acid | 組成式: | C28 H24 Cl F3 N2 O3 | SMILES: | n3(C(C1CCCCC1)COc2c(F)cc(C(O)=O)cc2)c5cc(F)c(cc5nc3c4ccc(cc4)Cl)F | InChi: | InChI=1S/C28H24ClF3N2O3/c29-19-9-6-17(7-10-19)27-33-23-13-20(30)21(31)14-24(23)34(27)25(16-4-2-1-3-5-16)15-37-26-11-8-18(28(35)36)12-22(26)32/h6-14,16,25H,1-5,15H2,(H,35,36)/t25-/m1/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | 4-{(2S)-2-[2-(4-chlorophenyl)-5,6-difluoro-1H-benzimidazol-1-yl]-2-cyclohexylethoxy}-3-fluorobenzoic acid |
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![9MP 9MP](https://data.pdbj.org/pdbjplus/data/cc/svg/9MP.svg) | 9MP | 表記: | (2S)-N,2-dicyclohexyl-2-{5,6-difluoro-2-[(R)-methoxy(phenyl)methyl]-1H-benzimidazol-1-yl}acetamide | 組成式: | C29 H35 F2 N3 O2 | SMILES: | c43n(C(C(=O)NC1CCCCC1)C2CCCCC2)c(nc3cc(c(c4)F)F)C(OC)c5ccccc5 | InChi: | InChI=1S/C29H35F2N3O2/c1-36-27(20-13-7-3-8-14-20)28-33-24-17-22(30)23(31)18-25(24)34(28)26(19-11-5-2-6-12-19)29(35)32-21-15-9-4-10-16-21/h3,7-8,13-14,17-19,21,26-27H,2,4-6,9-12,15-16H2,1H3,(H,32,35)/t26-,27+/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-N,2-dicyclohexyl-2-{5,6-difluoro-2-[(R)-methoxy(phenyl)methyl]-1H-benzimidazol-1-yl}acetamide |
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![9MS 9MS](https://data.pdbj.org/pdbjplus/data/cc/svg/9MS.svg) | 9MS | 表記: | (2S)-2-{2-[(4-chloro-2-methylphenoxy)methyl]-6-fluoro-1H-benzimidazol-1-yl}-N,2-dicyclohexylacetamide | 組成式: | C29 H35 Cl F N3 O2 | SMILES: | c43n(C(C(=O)NC1CCCCC1)C2CCCCC2)c(nc3ccc(c4)F)COc5ccc(cc5C)Cl | InChi: | InChI=1S/C29H35ClFN3O2/c1-19-16-21(30)12-15-26(19)36-18-27-33-24-14-13-22(31)17-25(24)34(27)28(20-8-4-2-5-9-20)29(35)32-23-10-6-3-7-11-23/h12-17,20,23,28H,2-11,18H2,1H3,(H,32,35)/t28-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-2-{2-[(4-chloro-2-methylphenoxy)methyl]-6-fluoro-1H-benzimidazol-1-yl}-N,2-dicyclohexylacetamide |
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![9MY 9MY](https://data.pdbj.org/pdbjplus/data/cc/svg/9MY.svg) | 9MY | 表記: | (2S)-2-cyclohexyl-2-{5,6-difluoro-2-[(R)-methoxy(phenyl)methyl]-1H-benzimidazol-1-yl}-N-(trans-4-hydroxycyclohexyl)acetamide | 組成式: | C29 H35 F2 N3 O3 | SMILES: | n3(C(C(=O)NC1CCC(CC1)O)C2CCCCC2)c5cc(c(cc5nc3C(c4ccccc4)OC)F)F | InChi: | InChI=1S/C29H35F2N3O3/c1-37-27(19-10-6-3-7-11-19)28-33-24-16-22(30)23(31)17-25(24)34(28)26(18-8-4-2-5-9-18)29(36)32-20-12-14-21(35)15-13-20/h3,6-7,10-11,16-18,20-21,26-27,35H,2,4-5,8-9,12-15H2,1H3,(H,32,36)/t20-,21-,26-,27+/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-2-cyclohexyl-2-{5,6-difluoro-2-[(R)-methoxy(phenyl)methyl]-1H-benzimidazol-1-yl}-N-(trans-4-hydroxycyclohexyl)acetamide |
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![9N1 9N1](https://data.pdbj.org/pdbjplus/data/cc/svg/9N1.svg) | 9N1 | 表記: | (2S)-N,2-dicyclohexyl-2-[2-(2,4-dimethoxyphenyl)-1H-benzimidazol-1-yl]acetamide | 組成式: | C29 H37 N3 O3 | SMILES: | n3c5c(n(C(C(=O)NC1CCCCC1)C2CCCCC2)c3c4ccc(OC)cc4OC)cccc5 | InChi: | InChI=1S/C29H37N3O3/c1-34-22-17-18-23(26(19-22)35-2)28-31-24-15-9-10-16-25(24)32(28)27(20-11-5-3-6-12-20)29(33)30-21-13-7-4-8-14-21/h9-10,15-21,27H,3-8,11-14H2,1-2H3,(H,30,33)/t27-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-N,2-dicyclohexyl-2-[2-(2,4-dimethoxyphenyl)-1H-benzimidazol-1-yl]acetamide |
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![9N4 9N4](https://data.pdbj.org/pdbjplus/data/cc/svg/9N4.svg) | 9N4 | 表記: | (2S)-2-cyclohexyl-2-[2-(2,4-dimethoxyphenyl)-1H-benzimidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide | 組成式: | C31 H35 N3 O3 | SMILES: | n3c5c(n(C(C(=O)Nc1c(C)cccc1C)C2CCCCC2)c3c4ccc(cc4OC)OC)cccc5 | InChi: | InChI=1S/C31H35N3O3/c1-20-11-10-12-21(2)28(20)33-31(35)29(22-13-6-5-7-14-22)34-26-16-9-8-15-25(26)32-30(34)24-18-17-23(36-3)19-27(24)37-4/h8-12,15-19,22,29H,5-7,13-14H2,1-4H3,(H,33,35)/t29-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | (2S)-2-cyclohexyl-2-[2-(2,4-dimethoxyphenyl)-1H-benzimidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide |
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![9N7 9N7](https://data.pdbj.org/pdbjplus/data/cc/svg/9N7.svg) | 9N7 | 表記: | 4-{[(2S)-2-cyclohexyl-2-{5,6-difluoro-2-[4-(1,3-thiazol-2-yl)phenyl]-1H-benzimidazol-1-yl}acetyl]amino}benzoic acid | 組成式: | C31 H26 F2 N4 O3 S | SMILES: | n1(c4cc(F)c(cc4nc1c2ccc(cc2)c3nccs3)F)C(C(=O)Nc5ccc(cc5)C(O)=O)C6CCCCC6 | InChi: | InChI=1S/C31H26F2N4O3S/c32-23-16-25-26(17-24(23)33)37(28(36-25)19-6-8-20(9-7-19)30-34-14-15-41-30)27(18-4-2-1-3-5-18)29(38)35-22-12-10-21(11-13-22)31(39)40/h6-18,27H,1-5H2,(H,35,38)(H,39,40)/t27-/m0/s1 | 定義日: | 2017-05-19 | 最終更新日: | 2017-06-30 | 公開日: | 2017-07-05 | 識別子(ID): | 4-{[(2S)-2-cyclohexyl-2-{5,6-difluoro-2-[4-(1,3-thiazol-2-yl)phenyl]-1H-benzimidazol-1-yl}acetyl]amino}benzoic acid |
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