![SWV SWV](https://data.pdbj.org/pdbjplus/data/cc/svg/SWV.svg) | SWV | 表記: | ~{N}-[3-[(2-fluorophenyl)sulfamoyl]phenyl]pyrazine-2-carboxamide | 組成式: | C17 H13 F N4 O3 S | SMILES: | Fc1ccccc1N[S](=O)(=O)c2cccc(NC(=O)c3cnccn3)c2 | InChi: | InChI=1S/C17H13FN4O3S/c18-14-6-1-2-7-15(14)22-26(24,25)13-5-3-4-12(10-13)21-17(23)16-11-19-8-9-20-16/h1-11,22H,(H,21,23) | 定義日: | 2020-03-13 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | ~{N}-[3-[(2-fluorophenyl)sulfamoyl]phenyl]pyrazine-2-carboxamide |
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![UK7 UK7](https://data.pdbj.org/pdbjplus/data/cc/svg/UK7.svg) | UK7 | 表記: | 3-[6-(aminomethyl)-1-(2-hydroxyethyl)-1H-indol-3-yl]benzene-1-carbothioamide | 組成式: | C18 H19 N3 O S | SMILES: | C(=S)(N)c3cc(c2c1c(cc(cc1)CN)n(c2)CCO)ccc3 | InChi: | InChI=1S/C18H19N3OS/c19-10-12-4-5-15-16(11-21(6-7-22)17(15)8-12)13-2-1-3-14(9-13)18(20)23/h1-5,8-9,11,22H,6-7,10,19H2,(H2,20,23) | 定義日: | 2020-05-19 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | 3-[6-(aminomethyl)-1-(2-hydroxyethyl)-1H-indol-3-yl]benzene-1-carbothioamide |
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![U5J U5J](https://data.pdbj.org/pdbjplus/data/cc/svg/U5J.svg) | U5J | 表記: | [(2R)-3-{[2-(carboxymethoxy)benzene-1-carbonyl]amino}-2-methoxypropyl](hydroxy)mercury | 組成式: | C13 H17 Hg N O6 | SMILES: | c1cc(C(=O)NCC(C[Hg]O)OC)c(cc1)OCC(O)=O | InChi: | InChI=1S/C13H16NO5.Hg.H2O/c1-9(18-2)7-14-13(17)10-5-3-4-6-11(10)19-8-12(15)16 | 定義日: | 2020-04-23 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | [(2R)-3-{[2-(carboxymethoxy)benzene-1-carbonyl]amino}-2-methoxypropyl](hydroxy)mercury |
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![U61 U61](https://data.pdbj.org/pdbjplus/data/cc/svg/U61.svg) | U61 | 表記: | 2,6-anhydro-1,4-dideoxy-1-[4-(4-fluorophenyl)-1H-1,2,3-triazol-1-yl]-4-(4-phenyl-1H-1,2,3-triazol-1-yl)-D-glycero-L-manno-heptitol | 組成式: | C23 H23 F N6 O4 | SMILES: | c1c(ccc(c1)F)c2cn(nn2)CC3C(O)C(C(C(O3)CO)O)n4cc(nn4)c5ccccc5 | InChi: | InChI=1S/C23H23FN6O4/c24-16-8-6-15(7-9-16)17-10-29(27-25-17)12-19-22(32)21(23(33)20(13-31)34-19)30-11-18(26-28-30)14-4-2-1-3-5-14/h1-11,19-23,31-33H,12-13H2/t19-,20+,21+,22-,23-/m0/s1 | 定義日: | 2020-04-23 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | 2,6-anhydro-1,4-dideoxy-1-[4-(4-fluorophenyl)-1H-1,2,3-triazol-1-yl]-4-(4-phenyl-1H-1,2,3-triazol-1-yl)-D-glycero-L-manno-heptitol |
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![UKZ UKZ](https://data.pdbj.org/pdbjplus/data/cc/svg/UKZ.svg) | UKZ | 表記: | N-((1S,2R)-1-(3-chloro-2-methylphenyl)-1-hydroxypentan-2-yl)-2-oxoindoline-4-carboxamide | 組成式: | C21 H23 Cl N2 O3 | SMILES: | CCC[CH](NC(=O)c1cccc2NC(=O)Cc12)[CH](O)c3cccc(Cl)c3C | InChi: | InChI=1S/C21H23ClN2O3/c1-3-6-18(20(26)13-7-4-9-16(22)12(13)2)24-21(27)14-8-5-10-17-15(14)11-19(25)23-17/h4-5,7-10,18,20,26H,3,6,11H2,1-2H3,(H,23,25)(H,24,27)/t18-,20+/m1/s1 | 別名: | ~{N}-[(1~{S},2~{R})-1-(3-chloranyl-2-methyl-phenyl)-1-oxidanyl-pentan-2-yl]-2-oxidanylidene-1,3-dihydroindole-4-carboxamide | 定義日: | 2021-03-01 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | ~{N}-[(1~{S},2~{R})-1-(3-chloranyl-2-methyl-phenyl)-1-oxidanyl-pentan-2-yl]-2-oxidanylidene-1,3-dihydroindole-4-carboxamide |
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![UL2 UL2](https://data.pdbj.org/pdbjplus/data/cc/svg/UL2.svg) | UL2 | 表記: | N-((1S,2R)-1-hydroxy-1-(o-tolyl)pentan-2-yl)-2-oxo-2,3-dihydrobenzo[d]oxazole-5-carboxamide | 組成式: | C20 H22 N2 O4 | SMILES: | CCC[CH](NC(=O)c1ccc2OC(=O)Nc2c1)[CH](O)c3ccccc3C | InChi: | InChI=1S/C20H22N2O4/c1-3-6-15(18(23)14-8-5-4-7-12(14)2)21-19(24)13-9-10-17-16(11-13)22-20(25)26-17/h4-5,7-11,15,18,23H,3,6H2,1-2H3,(H,21,24)(H,22,25)/t15-,18+/m1/s1 | 別名: | ~{N}-[(1~{S},2~{R})-1-(2-methylphenyl)-1-oxidanyl-pentan-2-yl]-2-oxidanylidene-3~{H}-1,3-benzoxazole-5-carboxamide | 定義日: | 2021-03-01 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | ~{N}-[(1~{S},2~{R})-1-(2-methylphenyl)-1-oxidanyl-pentan-2-yl]-2-oxidanylidene-3~{H}-1,3-benzoxazole-5-carboxamide |
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![U7B U7B](https://data.pdbj.org/pdbjplus/data/cc/svg/U7B.svg) | U7B | 表記: | 2'-deoxy-2'2'-difluorodeoxycytidine | 組成式: | C9 H12 F2 N3 O7 P | SMILES: | NC1=NC(=O)N(C=C1)[CH]2O[CH](CO[P](O)(O)=O)[CH](O)C2(F)F | InChi: | InChI=1S/C9H12F2N3O7P/c10-9(11)6(15)4(3-20-22(17,18)19)21-7(9)14-2-1-5(12)13-8(14)16/h1-2,4,6-7,15H,3H2,(H2,12,13,16)(H2,17,18,19)/t4-,6-,7-/m1/s1 | 別名: | [(2~{R},3~{R},5~{R})-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-4,4-bis(fluoranyl)-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphite | 定義日: | 2021-01-27 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | [(2~{R},3~{R},5~{R})-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-4,4-bis(fluoranyl)-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate |
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![V0B V0B](https://data.pdbj.org/pdbjplus/data/cc/svg/V0B.svg) | V0B | 表記: | N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxidanylidene-pyrido[1,2-a]pyrimidine-2-carboxamide | 組成式: | C18 H15 N5 O2 | SMILES: | Cc1ccc2nc(CNC(=O)C3=CC(=O)N4C=CC=CC4=N3)cn2c1 | InChi: | InChI=1S/C18H15N5O2/c1-12-5-6-15-20-13(11-22(15)10-12)9-19-18(25)14-8-17(24)23-7-3-2-4-16(23)21-14/h2-8,10-11H,9H2,1H3,(H,19,25) | 別名: | ~{N}-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxidanylidene-pyrido[1,2-a]pyrimidine-2-carboxamide | 定義日: | 2021-03-31 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | ~{N}-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxidanylidene-pyrido[1,2-a]pyrimidine-2-carboxamide |
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![UME UME](https://data.pdbj.org/pdbjplus/data/cc/svg/UME.svg) | UME | 表記: | N-ethyl-2-(1-methyl-1H-1,2,3-triazol-4-yl)-6-(1-phenylethyl)isonicotinamide | 組成式: | C19 H21 N5 O | SMILES: | CCNC(=O)c1cc(nc(c1)c2cn(C)nn2)[CH](C)c3ccccc3 | InChi: | InChI=1S/C19H21N5O/c1-4-20-19(25)15-10-16(13(2)14-8-6-5-7-9-14)21-17(11-15)18-12-24(3)23-22-18/h5-13H,4H2,1-3H3,(H,20,25)/t13-/m0/s1 | 別名: | ~{N}-ethyl-2-(1-methyl-1,2,3-triazol-4-yl)-6-(1-phenylethyl)pyridine-4-carboxamide | 定義日: | 2021-03-02 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | ~{N}-ethyl-2-(1-methyl-1,2,3-triazol-4-yl)-6-(1-phenylethyl)pyridine-4-carboxamide |
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![SZG SZG](https://data.pdbj.org/pdbjplus/data/cc/svg/SZG.svg) | SZG | 表記: | ~{N}-[5-[[4-[bis(fluoranyl)methoxy]phenyl]sulfamoyl]-2-chloranyl-phenyl]-3,5-bis(fluoranyl)benzamide | 組成式: | C20 H13 Cl F4 N2 O4 S | SMILES: | FC(F)Oc1ccc(N[S](=O)(=O)c2ccc(Cl)c(NC(=O)c3cc(F)cc(F)c3)c2)cc1 | InChi: | InChI=1S/C20H13ClF4N2O4S/c21-17-6-5-16(10-18(17)26-19(28)11-7-12(22)9-13(23)8-11)32(29,30)27-14-1-3-15(4-2-14)31-20(24)25/h1-10,20,27H,(H,26,28) | 定義日: | 2020-03-13 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | ~{N}-[5-[[4-[bis(fluoranyl)methoxy]phenyl]sulfamoyl]-2-chloranyl-phenyl]-3,5-bis(fluoranyl)benzamide |
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![SZJ SZJ](https://data.pdbj.org/pdbjplus/data/cc/svg/SZJ.svg) | SZJ | 表記: | ~{N}-[3-[[4-[bis(fluoranyl)methoxy]phenyl]sulfamoyl]phenyl]-3,5-bis(fluoranyl)benzamide | 組成式: | C20 H14 F4 N2 O4 S | SMILES: | FC(F)Oc1ccc(N[S](=O)(=O)c2cccc(NC(=O)c3cc(F)cc(F)c3)c2)cc1 | InChi: | InChI=1S/C20H14F4N2O4S/c21-13-8-12(9-14(22)10-13)19(27)25-16-2-1-3-18(11-16)31(28,29)26-15-4-6-17(7-5-15)30-20(23)24/h1-11,20,26H,(H,25,27) | 定義日: | 2020-03-13 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | ~{N}-[3-[[4-[bis(fluoranyl)methoxy]phenyl]sulfamoyl]phenyl]-3,5-bis(fluoranyl)benzamide |
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![SZP SZP](https://data.pdbj.org/pdbjplus/data/cc/svg/SZP.svg) | SZP | 表記: | N-(2-chloro-5-{[4-(trifluoromethoxy)phenyl]sulfamoyl}phenyl)-3,5-difluorobenzamide | 組成式: | C20 H12 Cl F5 N2 O4 S | SMILES: | N(S(c1cc(c(Cl)cc1)NC(=O)c2cc(cc(c2)F)F)(=O)=O)c3ccc(cc3)OC(F)(F)F | InChi: | InChI=1S/C20H12ClF5N2O4S/c21-17-6-5-16(10-18(17)27-19(29)11-7-12(22)9-13(23)8-11)33(30,31)28-14-1-3-15(4-2-14)32-20(24,25)26/h1-10,28H,(H,27,29) | 定義日: | 2020-03-13 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | N-(2-chloro-5-{[4-(trifluoromethoxy)phenyl]sulfamoyl}phenyl)-3,5-difluorobenzamide |
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![U8Q U8Q](https://data.pdbj.org/pdbjplus/data/cc/svg/U8Q.svg) | U8Q | 表記: | 4-[4-(trifluoromethyl)phenoxy]piperidine | 組成式: | C12 H14 F3 N O | SMILES: | FC(F)(F)c1ccc(OC2CCNCC2)cc1 | InChi: | InChI=1S/C12H14F3NO/c13-12(14,15)9-1-3-10(4-2-9)17-11-5-7-16-8-6-11/h1-4,11,16H,5-8H2 | 定義日: | 2021-02-02 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | 4-[4-(trifluoromethyl)phenoxy]piperidine |
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![U8T U8T](https://data.pdbj.org/pdbjplus/data/cc/svg/U8T.svg) | U8T | 表記: | 6-bromanylspiro[3~{H}-chromene-2,4'-piperidine]-4-one | 組成式: | C13 H14 Br N O2 | SMILES: | Brc1ccc2OC3(CCNCC3)CC(=O)c2c1 | InChi: | InChI=1S/C13H14BrNO2/c14-9-1-2-12-10(7-9)11(16)8-13(17-12)3-5-15-6-4-13/h1-2,7,15H,3-6,8H2 | 定義日: | 2021-02-02 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | 6-bromanylspiro[3~{H}-chromene-2,4'-piperidine]-4-one |
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![UO2 UO2](https://data.pdbj.org/pdbjplus/data/cc/svg/UO2.svg) | UO2 | 表記: | (2~{S})-2-azanyl-~{N}-[3-[3-(dimethylsulfamoyl)phenyl]-2~{H}-indazol-5-yl]propanamide | 組成式: | C18 H21 N5 O3 S | SMILES: | C[CH](N)C(=O)Nc1ccc2n[nH]c(c3cccc(c3)[S](=O)(=O)N(C)C)c2c1 | InChi: | InChI=1S/C18H21N5O3S/c1-11(19)18(24)20-13-7-8-16-15(10-13)17(22-21-16)12-5-4-6-14(9-12)27(25,26)23(2)3/h4-11H,19H2,1-3H3,(H,20,24)(H,21,22)/t11-/m0/s1 | 定義日: | 2021-03-02 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | (2~{S})-2-azanyl-~{N}-[3-[3-(dimethylsulfamoyl)phenyl]-2~{H}-indazol-5-yl]propanamide |
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![U9B U9B](https://data.pdbj.org/pdbjplus/data/cc/svg/U9B.svg) | U9B | 表記: | (1R,3S)-3-(4-ammoniobutyl)-1-benzyl-1,4-azaphosphinan-1-ium-3-carboxylate 4,4-dioxide | 組成式: | C16 H27 N2 O4 P | SMILES: | [NH3+]CCCC[C]1(C[NH+](CC[P]1(O)=O)Cc2ccccc2)C(O)=O | InChi: | InChI=1S/C16H25N2O4P/c17-9-5-4-8-16(15(19)20)13-18(10-11-23(16,21)22)12-14-6-2-1-3-7-14/h1-3,6-7H,4-5,8-13,17H2,(H,19,20)(H,21,22)/p+2/t16-/m0/s1 | 別名: | 4-[(1~{R},3~{S})-3-carboxy-4-oxidanyl-4-oxidanylidene-1-(phenylmethyl)-1,4$l^{5}-azaphosphinan-1-ium-3-yl]butylazanium | 定義日: | 2021-02-04 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | 4-[(1~{R},3~{S})-3-carboxy-4-oxidanyl-4-oxidanylidene-1-(phenylmethyl)-1,4$l^{5}-azaphosphinan-1-ium-3-yl]butylazanium |
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![U9K U9K](https://data.pdbj.org/pdbjplus/data/cc/svg/U9K.svg) | U9K | 表記: | (1R,3S)-3-(4-ammoniobutyl)-1-(4-fluoro-2-(1-methyl-1H-imidazol-5-yl)benzyl)-1,4-azaphosphinan-1-ium-3-carboxylate 4,4-dioxide | 組成式: | C20 H30 F N4 O4 P | SMILES: | Cn1cncc1c2cc(F)ccc2C[NH+]3CC[P](O)(=O)[C](CCCC[NH3+])(C3)C(O)=O | InChi: | InChI=1S/C20H28FN4O4P/c1-24-14-23-11-18(24)17-10-16(21)5-4-15(17)12-25-8-9-30(28,29)20(13-25,19(26)27)6-2-3-7-22/h4-5,10-11,14H,2-3,6-9,12-13,22H2,1H3,(H,26,27)(H,28,29)/p+2/t20-/m0/s1 | 別名: | 4-[(1~{R},3~{S})-3-carboxy-1-[[4-fluoranyl-2-(3-methylimidazol-4-yl)phenyl]methyl]-4-oxidanyl-4-oxidanylidene-1,4$l^{5}-azaphosphinan-1-ium-3-yl]butylazanium | 定義日: | 2021-02-07 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | 4-[(1~{R},3~{S})-3-carboxy-1-[[4-fluoranyl-2-(3-methylimidazol-4-yl)phenyl]methyl]-4-oxidanyl-4-oxidanylidene-1,4$l^{5}-azaphosphinan-1-ium-3-yl]butylazanium |
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![Q9Q Q9Q](https://data.pdbj.org/pdbjplus/data/cc/svg/Q9Q.svg) | Q9Q | 表記: | 4-((1-(2-(2-(2-(2-hydroxyethoxy)ethoxy)ethoxy)ethyl)-1H-1,2,3-triazol-4-yl)methoxy)benzyl-a-L-thiofucoside | 組成式: | C24 H37 N3 O9 S | SMILES: | C[CH]1O[CH](SCc2ccc(OCc3cn(CCOCCOCCOCCO)nn3)cc2)[CH](O)[CH](O)[CH]1O | InChi: | InChI=1S/C24H37N3O9S/c1-17-21(29)22(30)23(31)24(36-17)37-16-18-2-4-20(5-3-18)35-15-19-14-27(26-25-19)6-8-32-10-12-34-13-11-33-9-7-28/h2-5,14,17,21-24,28-31H,6-13,15-16H2,1H3/t17-,21+,22+,23-,24-/m0/s1 | 別名: | (2~{S},3~{S},4~{R},5~{S},6~{S})-2-[[4-[[1-[2-[2-[2-(2-hydroxyethyloxy)ethoxy]ethoxy]ethyl]-1,2,3-triazol-4-yl]methoxy]p
henyl]methylsulfanyl]-6-methyl-oxane-3,4,5-triol | 定義日: | 2020-05-28 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | (2~{S},3~{S},4~{R},5~{S},6~{S})-2-[[4-[[1-[2-[2-[2-(2-hydroxyethyloxy)ethoxy]ethoxy]ethyl]-1,2,3-triazol-4-yl]methoxy]phenyl]methylsulfanyl]-6-methyl-oxane-3,4,5-triol |
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![OPW OPW](https://data.pdbj.org/pdbjplus/data/cc/svg/OPW.svg) | OPW | 表記: | ~{N}-[5-(5-methoxy-1,3-benzothiazol-2-yl)pyridin-3-yl]ethanamide | 組成式: | C15 H13 N3 O2 S | SMILES: | COc1ccc2sc(nc2c1)c3cncc(NC(C)=O)c3 | InChi: | InChI=1S/C15H13N3O2S/c1-9(19)17-11-5-10(7-16-8-11)15-18-13-6-12(20-2)3-4-14(13)21-15/h3-8H,1-2H3,(H,17,19) | 定義日: | 2020-03-26 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | ~{N}-[5-(5-methoxy-1,3-benzothiazol-2-yl)pyridin-3-yl]ethanamide |
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![OQT OQT](https://data.pdbj.org/pdbjplus/data/cc/svg/OQT.svg) | OQT | 表記: | 2-[(1S)-1,2,3,4-Tetrahydronapthalen-1-ylamino)-3,5,6-trifluorobenzenesulfonamide | 組成式: | C16 H13 F3 N2 O2 S | SMILES: | N[S](=O)(=O)c1c(F)c(F)cc(F)c1N[CH]2C=CCc3ccccc23 | InChi: | InChI=1S/C16H13F3N2O2S/c17-11-8-12(18)15(16(14(11)19)24(20,22)23)21-13-7-3-5-9-4-1-2-6-10(9)13/h1-4,6-8,13,21H,5H2,(H2,20,22,23)/t13-/m0/s1 | 別名: | 2-[[(1~{S})-1,4-dihydronaphthalen-1-yl]amino]-3,5,6-tris(fluoranyl)benzenesulfonamide | 定義日: | 2020-03-30 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | 2-[[(1~{S})-1,4-dihydronaphthalen-1-yl]amino]-3,5,6-tris(fluoranyl)benzenesulfonamide |
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![OQW OQW](https://data.pdbj.org/pdbjplus/data/cc/svg/OQW.svg) | OQW | 表記: | 2-(Cyclooctylamino)-3,5,6-trifluorobenzenesulfonamide | 組成式: | C14 H19 F3 N2 O2 S | SMILES: | N[S](=O)(=O)c1c(F)c(F)cc(F)c1NC2CCCCCCC2 | InChi: | InChI=1S/C14H19F3N2O2S/c15-10-8-11(16)13(14(12(10)17)22(18,20)21)19-9-6-4-2-1-3-5-7-9/h8-9,19H,1-7H2,(H2,18,20,21) | 別名: | 2-(cyclooctylamino)-3,5,6-tris(fluoranyl)benzenesulfonamide | 定義日: | 2020-03-30 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | 2-(cyclooctylamino)-3,5,6-tris(fluoranyl)benzenesulfonamide |
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![QEE QEE](https://data.pdbj.org/pdbjplus/data/cc/svg/QEE.svg) | QEE | 表記: | ~{tert}-butyl 6-[5-oxidanyl-4-(1,2,3-triazol-1-yl)pyrazol-1-yl]pyridine-3-carboxylate | 組成式: | C15 H16 N6 O3 | SMILES: | CC(C)(C)OC(=O)c1ccc(nc1)n2ncc(n3ccnn3)c2O | InChi: | InChI=1S/C15H16N6O3/c1-15(2,3)24-14(23)10-4-5-12(16-8-10)21-13(22)11(9-18-21)20-7-6-17-19-20/h4-9,22H,1-3H3 | 別名: | tert-butyl 6-(5-hydroxy-4-(1H-1,2,3-triazol-1-yl)-1H-pyrazol-1-yl)nicotinate | 定義日: | 2020-06-10 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | ~{tert}-butyl 6-[5-oxidanyl-4-(1,2,3-triazol-1-yl)pyrazol-1-yl]pyridine-3-carboxylate |
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![QEQ QEQ](https://data.pdbj.org/pdbjplus/data/cc/svg/QEQ.svg) | QEQ | 表記: | 2-(6-morpholin-4-ylpyrimidin-4-yl)-4-(1,2,3-triazol-1-yl)pyrazol-3-ol | 組成式: | C13 H14 N8 O2 | SMILES: | Oc1n(ncc1n2ccnn2)c3cc(ncn3)N4CCOCC4 | InChi: | InChI=1S/C13H14N8O2/c22-13-10(20-2-1-16-18-20)8-17-21(13)12-7-11(14-9-15-12)19-3-5-23-6-4-19/h1-2,7-9,22H,3-6H2 | 別名: | 1-(6-morpholinopyrimidin-4-yl)-4-(1H-1,2,3-triazol-1-yl)-1H-pyrazol-5-ol | 定義日: | 2020-06-10 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | 2-(6-morpholin-4-ylpyrimidin-4-yl)-4-(1,2,3-triazol-1-yl)pyrazol-3-ol |
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![LXH LXH](https://data.pdbj.org/pdbjplus/data/cc/svg/LXH.svg) | LXH | 表記: | methyl (2~{S})-2-phenylpropanoate | 組成式: | C10 H12 O2 | SMILES: | COC(=O)[CH](C)c1ccccc1 | InChi: | InChI=1S/C10H12O2/c1-8(10(11)12-2)9-6-4-3-5-7-9/h3-8H,1-2H3/t8-/m0/s1 | 定義日: | 2019-09-27 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | methyl (2~{S})-2-phenylpropanoate |
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![LY8 LY8](https://data.pdbj.org/pdbjplus/data/cc/svg/LY8.svg) | LY8 | 表記: | methyl (2~{R})-2-phenylpropanoate | 組成式: | C10 H12 O2 | SMILES: | COC(=O)[CH](C)c1ccccc1 | InChi: | InChI=1S/C10H12O2/c1-8(10(11)12-2)9-6-4-3-5-7-9/h3-8H,1-2H3/t8-/m1/s1 | 定義日: | 2019-09-27 | 最終更新日: | 2021-04-02 | 公開日: | 2021-04-07 | 識別子(ID): | methyl (2~{R})-2-phenylpropanoate |
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