![BYJ BYJ](https://data.pdbj.org/pdbjplus/data/cc/svg/BYJ.svg) | BYJ | Name: | 4-methyl-6-(2-{3-[3-(methylamino)propyl]phenyl}ethyl)pyridin-2-amine | Formula: | C18 H25 N3 | SMILES: | Nc1cc(C)cc(n1)CCc2cccc(c2)CCCNC | InChi: | InChI=1S/C18H25N3/c1-14-11-17(21-18(19)12-14)9-8-16-6-3-5-15(13-16)7-4-10-20-2/h3,5-6,11-13,20H,4,7-10H2,1-2H3,(H2,19,21) | Definition date: | 2017-09-05 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 4-methyl-6-(2-{3-[3-(methylamino)propyl]phenyl}ethyl)pyridin-2-amine |
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![BYV BYV](https://data.pdbj.org/pdbjplus/data/cc/svg/BYV.svg) | BYV | Name: | 3-[2-(6-amino-4-methylpyridin-2-yl)ethyl]-5-[3-(methylamino)propyl]benzonitrile | Formula: | C19 H24 N4 | SMILES: | N#Cc1cc(CCCNC)cc(c1)CCc2nc(N)cc(c2)C | InChi: | InChI=1S/C19H24N4/c1-14-8-18(23-19(21)9-14)6-5-16-10-15(4-3-7-22-2)11-17(12-16)13-20/h8-12,22H,3-7H2,1-2H3,(H2,21,23) | Definition date: | 2017-09-05 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 3-[2-(6-amino-4-methylpyridin-2-yl)ethyl]-5-[3-(methylamino)propyl]benzonitrile |
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![DUH DUH](https://data.pdbj.org/pdbjplus/data/cc/svg/DUH.svg) | DUH | Name: | 2-oxidanyl-~{N}-[2,3,5,6-tetrakis(fluoranyl)-4-phenyl-phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide | Formula: | C20 H11 F4 N3 O2 | SMILES: | Oc1nn2ccccc2c1C(=O)Nc3c(F)c(F)c(c(F)c3F)c4ccccc4 | InChi: | InChI=1S/C20H11F4N3O2/c21-14-12(10-6-2-1-3-7-10)15(22)17(24)18(16(14)23)25-19(28)13-11-8-4-5-9-27(11)26-20(13)29/h1-9H,(H,25,28)(H,26,29) | Definition date: | 2018-01-31 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 2-oxidanyl-~{N}-[2,3,5,6-tetrakis(fluoranyl)-4-phenyl-phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide |
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![E4Z E4Z](https://data.pdbj.org/pdbjplus/data/cc/svg/E4Z.svg) | E4Z | Name: | Baloxavir acid | Formula: | C24 H19 F2 N3 O4 S | SMILES: | OC1=C2N(C=CC1=O)N([CH]3COCCN3C2=O)[CH]4c5ccc(F)c(F)c5CSc6ccccc46 | InChi: | InChI=1S/C24H19F2N3O4S/c25-16-6-5-13-15(20(16)26)12-34-18-4-2-1-3-14(18)21(13)29-19-11-33-10-9-27(19)24(32)22-23(31)17(30)7-8-28(22)29/h1-8,19,21,31H,9-12H2/t19-,21+/m1/s1 | Definition date: | 2018-02-19 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (3~{R})-2-[(11~{S})-7,8-bis(fluoranyl)-6,11-dihydrobenzo[c][1]benzothiepin-11-yl]-11-oxidanyl-5-oxa-1,2,8-triazatricyclo[8.4.0.0^{3,8}]tetradeca-10,13-diene-9,12-dione |
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![EJ8 EJ8](https://data.pdbj.org/pdbjplus/data/cc/svg/EJ8.svg) | EJ8 | Name: | [(2~{R},4~{a}~{R},6~{R},7~{a}~{R})-6-[2,4-bis(oxidanylidene)-5-(phosphonomethylsulfanylmethyl)pyrimidin-1-yl]-2-phenyl-4~{a},6,7,7~{a}-tetrahydro-4~{H}-furo[3,2-d][1,3]dioxin-2-yl]phosphonic acid | Formula: | C18 H22 N2 O11 P2 S | SMILES: | O[P](O)(=O)CSCC1=CN([CH]2C[CH]3O[C](OC[CH]3O2)(c4ccccc4)[P](O)(O)=O)C(=O)NC1=O | InChi: | InChI=1S/C18H22N2O11P2S/c21-16-11(9-34-10-32(23,24)25)7-20(17(22)19-16)15-6-13-14(30-15)8-29-18(31-13,33(26,27)28)12-4-2-1-3-5-12/h1-5,7,13-15H,6,8-10H2,(H,19,21,22)(H2,23,24,25)(H2,26,27,28)/t13-,14-,15-,18-/m1/s1 | Definition date: | 2018-03-23 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | [(2~{R},4~{a}~{R},6~{R},7~{a}~{R})-6-[2,4-bis(oxidanylidene)-5-(phosphonomethylsulfanylmethyl)pyrimidin-1-yl]-2-phenyl-4~{a},6,7,7~{a}-tetrahydro-4~{H}-furo[3,2-d][1,3]dioxin-2-yl]phosphonic acid |
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![EXE EXE](https://data.pdbj.org/pdbjplus/data/cc/svg/EXE.svg) | EXE | Name: | (2~{R},3~{S},4~{S})-1-[(2~{S})-2-acetamido-3,3-dimethyl-butanoyl]-3-fluoranyl-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide | Formula: | C24 H31 F N4 O4 S | SMILES: | CC(=O)N[CH](C(=O)N1C[CH](O)[CH](F)[CH]1C(=O)NCc2ccc(cc2)c3scnc3C)C(C)(C)C | InChi: | InChI=1S/C24H31FN4O4S/c1-13-20(34-12-27-13)16-8-6-15(7-9-16)10-26-22(32)19-18(25)17(31)11-29(19)23(33)21(24(3,4)5)28-14(2)30/h6-9,12,17-19,21,31H,10-11H2,1-5H3,(H,26,32)(H,28,30)/t17-,18+,19-,21+/m0/s1 | Definition date: | 2018-05-03 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2~{R},3~{S},4~{S})-1-[(2~{S})-2-acetamido-3,3-dimethyl-butanoyl]-3-fluoranyl-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide |
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![EXH EXH](https://data.pdbj.org/pdbjplus/data/cc/svg/EXH.svg) | EXH | Name: | (2~{R},3~{R},4~{S})-1-[(2~{S})-2-acetamido-3,3-dimethyl-butanoyl]-3-fluoranyl-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide | Formula: | C24 H31 F N4 O4 S | SMILES: | CC(=O)N[CH](C(=O)N1C[CH](O)[CH](F)[CH]1C(=O)NCc2ccc(cc2)c3scnc3C)C(C)(C)C | InChi: | InChI=1S/C24H31FN4O4S/c1-13-20(34-12-27-13)16-8-6-15(7-9-16)10-26-22(32)19-18(25)17(31)11-29(19)23(33)21(24(3,4)5)28-14(2)30/h6-9,12,17-19,21,31H,10-11H2,1-5H3,(H,26,32)(H,28,30)/t17-,18-,19-,21+/m0/s1 | Definition date: | 2018-05-03 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | (2~{R},3~{R},4~{S})-1-[(2~{S})-2-acetamido-3,3-dimethyl-butanoyl]-3-fluoranyl-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide |
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![F4Z F4Z](https://data.pdbj.org/pdbjplus/data/cc/svg/F4Z.svg) | F4Z | Name: | 3,5,6-trichloro-2-pyridinol | Formula: | C5 H2 Cl3 N O | SMILES: | Oc1nc(Cl)c(Cl)cc1Cl | InChi: | InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10) | Definition date: | 2018-05-31 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 3,5,6-tris(chloranyl)pyridin-2-ol |
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![F52 F52](https://data.pdbj.org/pdbjplus/data/cc/svg/F52.svg) | F52 | Name: | 2-[2,4,5-tris(chloranyl)phenoxy]ethanoic acid | Formula: | C8 H5 Cl3 O3 | SMILES: | OC(=O)COc1cc(Cl)c(Cl)cc1Cl | InChi: | InChI=1S/C8H5Cl3O3/c9-4-1-6(11)7(2-5(4)10)14-3-8(12)13/h1-2H,3H2,(H,12,13) | Definition date: | 2018-06-01 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 2-[2,4,5-tris(chloranyl)phenoxy]ethanoic acid |
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![GO7 GO7](https://data.pdbj.org/pdbjplus/data/cc/svg/GO7.svg) | GO7 | Name: | 2-{[(3R,4S)-3-fluoro-1-{[4-(trifluoromethoxy)phenyl]acetyl}piperidin-4-yl]oxy}-4-(2-hydroxy-2-methylpropoxy)benzamide | Formula: | C25 H28 F4 N2 O6 | SMILES: | c1c(C(N)=O)c(cc(c1)OCC(C)(C)O)OC3CCN(C(=O)Cc2ccc(cc2)OC(F)(F)F)CC3F | InChi: | InChI=1S/C25H28F4N2O6/c1-24(2,34)14-35-17-7-8-18(23(30)33)21(12-17)36-20-9-10-31(13-19(20)26)22(32)11-15-3-5-16(6-4-15)37-25(27,28)29/h3-8,12,19-20,34H,9-11,13-14H2,1-2H3,(H2,30,33)/t19-,20+/m1/s1 | Definition date: | 2018-05-30 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 2-{[(3R,4S)-3-fluoro-1-{[4-(trifluoromethoxy)phenyl]acetyl}piperidin-4-yl]oxy}-4-(2-hydroxy-2-methylpropoxy)benzamide |
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![GOD GOD](https://data.pdbj.org/pdbjplus/data/cc/svg/GOD.svg) | GOD | Name: | 6-amino-5-{[(3S)-4,4-difluoro-1-{[4-(trifluoromethoxy)phenyl]acetyl}pyrrolidin-3-yl]oxy}-N-methylpyridine-3-carboxamide | Formula: | C20 H19 F5 N4 O4 | SMILES: | c3c(cc(OC2C(F)(CN(C(=O)Cc1ccc(cc1)OC(F)(F)F)C2)F)c(N)n3)C(=O)NC | InChi: | InChI=1S/C20H19F5N4O4/c1-27-18(31)12-7-14(17(26)28-8-12)32-15-9-29(10-19(15,21)22)16(30)6-11-2-4-13(5-3-11)33-20(23,24)25/h2-5,7-8,15H,6,9-10H2,1H3,(H2,26,28)(H,27,31)/t15-/m0/s1 | Definition date: | 2018-05-30 | Last modified: | 2018-07-06 | Release date: | 2018-07-11 | Identifier: | 6-amino-5-{[(3S)-4,4-difluoro-1-{[4-(trifluoromethoxy)phenyl]acetyl}pyrrolidin-3-yl]oxy}-N-methylpyridine-3-carboxamide |
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![JX1 JX1](https://data.pdbj.org/pdbjplus/data/cc/svg/JX1.svg) | JX1 | Name: | N-[4-(4-methoxyphenyl)-3-[5-(8-methylquinolin-5-yl)-2,4-bis(oxidanyl)phenyl]-1,2-oxazol-5-yl]ethanamide | Formula: | C28 H23 N3 O5 | SMILES: | COc1ccc(cc1)c2c(NC(C)=O)onc2c3cc(c(O)cc3O)c4ccc(C)c5ncccc45 | InChi: | InChI=1S/C28H23N3O5/c1-15-6-11-19(20-5-4-12-29-26(15)20)21-13-22(24(34)14-23(21)33)27-25(28(36-31-27)30-16(2)32)17-7-9-18(35-3)10-8-17/h4-14,33-34H,1-3H3,(H,30,32) | Definition date: | 2017-06-15 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | ~{N}-[4-(4-methoxyphenyl)-3-[5-(8-methylquinolin-5-yl)-2,4-bis(oxidanyl)phenyl]-1,2-oxazol-5-yl]ethanamide |
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![V3A V3A](https://data.pdbj.org/pdbjplus/data/cc/svg/V3A.svg) | V3A | Name: | 9-{2-deoxy-5-O-[(R)-{[(R)-[(R)-fluoro(phosphono)methyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D-erythro-pentofuranosyl}-9H-purin-6-amine | Formula: | C11 H17 F N5 O11 P3 | SMILES: | P(=O)(O)(OP(O)(C(P(=O)(O)O)F)=O)OCC3OC(n1cnc2c1ncnc2N)CC3O | InChi: | InChI=1S/C11H17FN5O11P3/c12-11(29(19,20)21)30(22,23)28-31(24,25)26-2-6-5(18)1-7(27-6)17-4-16-8-9(13)14-3-15-10(8)17/h3-7,11,18H,1-2H2,(H,22,23)(H,24,25)(H2,13,14,15)(H2,19,20,21)/t5-,6+,7-,11+/m0/s1 | Definition date: | 2018-03-22 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | 9-{2-deoxy-5-O-[(R)-{[(R)-[(R)-fluoro(phosphono)methyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D-erythro-pentofuranosyl}-9H-purin-6-amine |
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![H7A H7A](https://data.pdbj.org/pdbjplus/data/cc/svg/H7A.svg) | H7A | Name: | 4-{[(4R)-6-fluoro-3,4-dihydro-2H-1-benzopyran-4-yl]sulfamoyl}-2,5-dimethylfuran-3-carboxylic acid | Formula: | C16 H16 F N O6 S | SMILES: | C2CC(c1c(ccc(c1)F)O2)NS(c3c(c(C)oc3C)C(O)=O)(=O)=O | InChi: | InChI=1S/C16H16FNO6S/c1-8-14(16(19)20)15(9(2)24-8)25(21,22)18-12-5-6-23-13-4-3-10(17)7-11(12)13/h3-4,7,12,18H,5-6H2,1-2H3,(H,19,20)/t12-/m1/s1 | Definition date: | 2018-06-11 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | 4-{[(4R)-6-fluoro-3,4-dihydro-2H-1-benzopyran-4-yl]sulfamoyl}-2,5-dimethylfuran-3-carboxylic acid |
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![H7D H7D](https://data.pdbj.org/pdbjplus/data/cc/svg/H7D.svg) | H7D | Name: | (1R,2S)-2-{[(pyrrolidin-1-yl)sulfonyl]amino}cyclooctane-1-carboxylic acid | Formula: | C13 H24 N2 O4 S | SMILES: | N(C1C(C(O)=O)CCCCCC1)S(N2CCCC2)(=O)=O | InChi: | InChI=1S/C13H24N2O4S/c16-13(17)11-7-3-1-2-4-8-12(11)14-20(18,19)15-9-5-6-10-15/h11-12,14H,1-10H2,(H,16,17)/t11-,12+/m1/s1 | Definition date: | 2018-06-11 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | (1R,2S)-2-{[(pyrrolidin-1-yl)sulfonyl]amino}cyclooctane-1-carboxylic acid |
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![H7G H7G](https://data.pdbj.org/pdbjplus/data/cc/svg/H7G.svg) | H7G | Name: | (3-{[(3-chloro-2-hydroxyphenyl)sulfonyl]amino}phenyl)acetic acid | Formula: | C14 H12 Cl N O5 S | SMILES: | c1c(c(O)c(cc1)Cl)S(Nc2cc(CC(=O)O)ccc2)(=O)=O | InChi: | InChI=1S/C14H12ClNO5S/c15-11-5-2-6-12(14(11)19)22(20,21)16-10-4-1-3-9(7-10)8-13(17)18/h1-7,16,19H,8H2,(H,17,18) | Definition date: | 2018-06-11 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | (3-{[(3-chloro-2-hydroxyphenyl)sulfonyl]amino}phenyl)acetic acid |
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![H7M H7M](https://data.pdbj.org/pdbjplus/data/cc/svg/H7M.svg) | H7M | Name: | 3-chloro-2-hydroxy-N-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]phenyl}benzene-1-sulfonamide | Formula: | C15 H13 Cl N4 O3 S2 | SMILES: | c2cc(c(NS(c1c(c(ccc1)Cl)O)(=O)=O)cc2)Sc3n(C)cnn3 | InChi: | InChI=1S/C15H13ClN4O3S2/c1-20-9-17-18-15(20)24-12-7-3-2-6-11(12)19-25(22,23)13-8-4-5-10(16)14(13)21/h2-9,19,21H,1H3 | Definition date: | 2018-06-11 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | 3-chloro-2-hydroxy-N-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]phenyl}benzene-1-sulfonamide |
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![H9V H9V](https://data.pdbj.org/pdbjplus/data/cc/svg/H9V.svg) | H9V | Name: | (2R,3S,4R)-3-(4'-chloro-2',6'-difluoro[1,1'-biphenyl]-4-yl)-4-(fluoromethyl)azetidine-2-carbonitrile | Formula: | C17 H12 Cl F3 N2 | SMILES: | c1cc(ccc1C2C(CF)NC2C#N)c3c(cc(cc3F)Cl)F | InChi: | InChI=1S/C17H12ClF3N2/c18-11-5-12(20)16(13(21)6-11)9-1-3-10(4-2-9)17-14(7-19)23-15(17)8-22/h1-6,14-15,17,23H,7H2/t14-,15-,17+/m0/s1 | Definition date: | 2018-06-20 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | (2R,3S,4R)-3-(4'-chloro-2',6'-difluoro[1,1'-biphenyl]-4-yl)-4-(fluoromethyl)azetidine-2-carbonitrile |
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![VA4 VA4](https://data.pdbj.org/pdbjplus/data/cc/svg/VA4.svg) | VA4 | Name: | 5'-O-[(R)-{[(R)-[(R)-chloro(phosphono)methyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-2'-deoxyadenosine | Formula: | C11 H17 Cl N5 O11 P3 | SMILES: | n1c(c2c(nc1)n(cn2)C3OC(C(C3)O)COP(=O)(O)OP(O)(C(P(=O)(O)O)Cl)=O)N | InChi: | InChI=1S/C11H17ClN5O11P3/c12-11(29(19,20)21)30(22,23)28-31(24,25)26-2-6-5(18)1-7(27-6)17-4-16-8-9(13)14-3-15-10(8)17/h3-7,11,18H,1-2H2,(H,22,23)(H,24,25)(H2,13,14,15)(H2,19,20,21)/t5-,6+,7+,11+/m0/s1 | Definition date: | 2018-03-22 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | 5'-O-[(R)-{[(R)-[(R)-chloro(phosphono)methyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-2'-deoxyadenosine |
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![VA5 VA5](https://data.pdbj.org/pdbjplus/data/cc/svg/VA5.svg) | VA5 | Name: | 9-{5-O-[(R)-{[(R)-[(S)-chloro(fluoro)phosphonomethyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-2-deoxy-alpha-D-threo-pentofuranosyl}-9H-purin-6-amine | Formula: | C11 H16 Cl F N5 O11 P3 | SMILES: | P(=O)(O)(OP(O)(C(Cl)(P(O)(O)=O)F)=O)OCC3OC(n1cnc2c1ncnc2N)CC3O | InChi: | InChI=1S/C11H16ClFN5O11P3/c12-11(13,30(20,21)22)31(23,24)29-32(25,26)27-2-6-5(19)1-7(28-6)18-4-17-8-9(14)15-3-16-10(8)18/h3-7,19H,1-2H2,(H,23,24)(H,25,26)(H2,14,15,16)(H2,20,21,22)/t5-,6-,7+,11-/m1/s1 | Definition date: | 2018-03-22 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | 9-{5-O-[(R)-{[(R)-[(S)-chloro(fluoro)phosphonomethyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-2-deoxy-alpha-D-threo-pentofuranosyl}-9H-purin-6-amine |
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![LON LON](https://data.pdbj.org/pdbjplus/data/cc/svg/LON.svg) | LON | Name: | (7S)-1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one | Formula: | C21 H25 N O5 | SMILES: | CN[CH]1CCc2cc(OC)c(OC)c(OC)c2C3=CC=C(OC)C(=O)C=C13 | InChi: | InChI=1S/C21H25NO5/c1-22-15-8-6-12-10-18(25-3)20(26-4)21(27-5)19(12)13-7-9-17(24-2)16(23)11-14(13)15/h7,9-11,15,22H,6,8H2,1-5H3/t15-/m0/s1 | Definition date: | 2017-05-18 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | (7~{S})-1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydro-5~{H}-benzo[a]heptalen-9-one |
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![7VC 7VC](https://data.pdbj.org/pdbjplus/data/cc/svg/7VC.svg) | 7VC | Name: | 4-(7-methoxyquinolin-4-yl)-2-methyl-phenol | Formula: | C17 H15 N O2 | SMILES: | COc1ccc2c(c1)nccc2c3ccc(O)c(C)c3 | InChi: | InChI=1S/C17H15NO2/c1-11-9-12(3-6-17(11)19)14-7-8-18-16-10-13(20-2)4-5-15(14)16/h3-10,19H,1-2H3 | Definition date: | 2017-01-19 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | 4-(7-methoxyquinolin-4-yl)-2-methyl-phenol |
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![7VL 7VL](https://data.pdbj.org/pdbjplus/data/cc/svg/7VL.svg) | 7VL | Name: | 4-(7-chloranylquinolin-4-yl)-2-methyl-phenol | Formula: | C16 H12 Cl N O | SMILES: | Cc1cc(ccc1O)c2ccnc3cc(Cl)ccc23 | InChi: | InChI=1S/C16H12ClNO/c1-10-8-11(2-5-16(10)19)13-6-7-18-15-9-12(17)3-4-14(13)15/h2-9,19H,1H3 | Definition date: | 2017-01-19 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | 4-(7-chloranylquinolin-4-yl)-2-methyl-phenol |
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![8WC 8WC](https://data.pdbj.org/pdbjplus/data/cc/svg/8WC.svg) | 8WC | Name: | 4-[2-(4-methylphenyl)-5-(piperidin-4-ylmethoxy)pyridin-3-yl]benzenecarbonitrile | Formula: | C25 H25 N3 O | SMILES: | Cc1ccc(cc1)c2ncc(OCC3CCNCC3)cc2c4ccc(cc4)C#N | InChi: | InChI=1S/C25H25N3O/c1-18-2-6-22(7-3-18)25-24(21-8-4-19(15-26)5-9-21)14-23(16-28-25)29-17-20-10-12-27-13-11-20/h2-9,14,16,20,27H,10-13,17H2,1H3 | Definition date: | 2017-10-13 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | 4-[2-(4-methylphenyl)-5-(piperidin-4-ylmethoxy)pyridin-3-yl]benzenecarbonitrile |
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![8DU 8DU](https://data.pdbj.org/pdbjplus/data/cc/svg/8DU.svg) | 8DU | Name: | N-[3-[5-chloranyl-2,4-bis(oxidanyl)phenyl]-4-(4-methoxyphenyl)-1,2-oxazol-5-yl]cyclopropanecarboxamide | Formula: | C20 H17 Cl N2 O5 | SMILES: | COc1ccc(cc1)c2c(NC(=O)C3CC3)onc2c4cc(Cl)c(O)cc4O | InChi: | InChI=1S/C20H17ClN2O5/c1-27-12-6-4-10(5-7-12)17-18(13-8-14(21)16(25)9-15(13)24)23-28-20(17)22-19(26)11-2-3-11/h4-9,11,24-25H,2-3H2,1H3,(H,22,26) | Definition date: | 2017-06-15 | Last modified: | 2018-06-29 | Release date: | 2018-07-04 | Identifier: | ~{N}-[3-[5-chloranyl-2,4-bis(oxidanyl)phenyl]-4-(4-methoxyphenyl)-1,2-oxazol-5-yl]cyclopropanecarboxamide |
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