![YC0 YC0](https://data.pdbj.org/pdbjplus/data/cc/svg/YC0.svg) | YC0 | Name: | methyl (2~{S})-2-[[(2~{R},4~{a}~{S},6~{a}~{R},6~{a}~{S},14~{a}~{S},14~{b}~{R})-2,4~{a},6~{a},6~{a},9,14~{a}-hexamethyl-10-oxidanyl-11-oxidanylidene-1,3,4,5,6,13,14,14~{b}-octahydropicen-2-yl]carbamoylamino]-3-oxidanyl-propanoate | Formula: | C33 H46 N2 O6 | SMILES: | COC(=O)[CH](CO)NC(=O)N[C]1(C)CC[C]2(C)CC[C]3(C)C4=CC=C5C(=C(O)C(=O)C=C5[C]4(C)CC[C]3(C)[CH]2C1)C | InChi: | InChI=1S/C33H46N2O6/c1-19-20-8-9-24-31(4,21(20)16-23(37)26(19)38)13-15-33(6)25-17-30(3,12-10-29(25,2)11-14-32(24,33)5)35-28(40)34-22(18-36)27(39)41-7/h8-9,16,22,25,36,38H,10-15,17-18H2,1-7H3,(H2,34,35,40)/t22-,25+,29+,30+,31-,32+,33-/m0/s1 | Definition date: | 2023-11-29 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | methyl (2~{S})-2-[[(2~{R},4~{a}~{S},6~{a}~{R},6~{a}~{S},14~{a}~{S},14~{b}~{R})-2,4~{a},6~{a},6~{a},9,14~{a}-hexamethyl-10-oxidanyl-11-oxidanylidene-1,3,4,5,6,13,14,14~{b}-octahydropicen-2-yl]carbamoylamino]-3-oxidanyl-propanoate |
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![YCC YCC](https://data.pdbj.org/pdbjplus/data/cc/svg/YCC.svg) | YCC | Name: | methyl 3-[[(2~{R},4~{a}~{S},6~{a}~{R},6~{a}~{S},14~{a}~{S},14~{b}~{R})-2,4~{a},6~{a},6~{a},9,14~{a}-hexamethyl-10-oxidanyl-11-oxidanylidene-1,3,4,5,6,13,14,14~{b}-octahydropicen-2-yl]carbamoylamino]oxetane-3-carboxylate | Formula: | C34 H46 N2 O6 | SMILES: | COC(=O)C1(COC1)NC(=O)N[C]2(C)CC[C]3(C)CC[C]4(C)C5=CC=C6C(=C(O)C(=O)C=C6[C]5(C)CC[C]4(C)[CH]3C2)C | InChi: | InChI=1S/C34H46N2O6/c1-20-21-8-9-24-31(4,22(21)16-23(37)26(20)38)13-15-33(6)25-17-30(3,12-10-29(25,2)11-14-32(24,33)5)35-28(40)36-34(18-42-19-34)27(39)41-7/h8-9,16,25,38H,10-15,17-19H2,1-7H3,(H2,35,36,40)/t25-,29-,30-,31+,32-,33+/m1/s1 | Definition date: | 2023-11-29 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | methyl 3-[[(2~{R},4~{a}~{S},6~{a}~{R},6~{a}~{S},14~{a}~{S},14~{b}~{R})-2,4~{a},6~{a},6~{a},9,14~{a}-hexamethyl-10-oxidanyl-11-oxidanylidene-1,3,4,5,6,13,14,14~{b}-octahydropicen-2-yl]carbamoylamino]oxetane-3-carboxylate |
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![USX USX](https://data.pdbj.org/pdbjplus/data/cc/svg/USX.svg) | USX | Name: | 2-[4-[[(2S)-1-ethanoyl-3-oxidanylidene-2H-indol-2-yl]methyl]-2-methoxy-phenoxy]ethanamide | Formula: | C20 H20 N2 O5 | SMILES: | COc1cc(C[CH]2N(C(C)=O)c3ccccc3C2=O)ccc1OCC(N)=O | InChi: | InChI=1S/C20H20N2O5/c1-12(23)22-15-6-4-3-5-14(15)20(25)16(22)9-13-7-8-17(18(10-13)26-2)27-11-19(21)24/h3-8,10,16H,9,11H2,1-2H3,(H2,21,24)/t16-/m0/s1 | Definition date: | 2023-06-19 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 2-[4-[[(2~{S})-1-ethanoyl-3-oxidanylidene-2~{H}-indol-2-yl]methyl]-2-methoxy-phenoxy]ethanamide |
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![YI7 YI7](https://data.pdbj.org/pdbjplus/data/cc/svg/YI7.svg) | YI7 | Name: | (3aM,9S,15R)-4-chloro-3-ethyl-7-{3-[(6-fluoronaphthalen-1-yl)oxy]propyl}-2-methyl-15-[2-(morpholin-4-yl)ethyl]-2,10,11,12,13,15-hexahydropyrazolo[4',3':9,10][1,6]oxazacycloundecino[8,7,6-hi]indole-8-carboxylic acid | Formula: | C39 H44 Cl F N4 O5 | SMILES: | Fc1ccc2c(c1)cccc2OCCCc1c2ccc(Cl)c3c4c(CC)n(C)nc4C(CCN4CCOCC4)OCCCCn(c1C(=O)O)c23 | InChi: | InChI=1S/C39H44ClFN4O5/c1-3-31-35-34-30(40)14-13-29-28(9-7-21-49-32-10-6-8-25-24-26(41)11-12-27(25)32)38(39(46)47)45(37(29)34)16-4-5-20-50-33(36(35)42-43(31)2)15-17-44-18-22-48-23-19-44/h6,8,10-14,24,33H,3-5,7,9,15-23H2,1-2H3,(H,46,47)/t33-/m1/s1 | Definition date: | 2023-06-19 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | (3aM,9S,15R)-4-chloro-3-ethyl-7-{3-[(6-fluoronaphthalen-1-yl)oxy]propyl}-2-methyl-15-[2-(morpholin-4-yl)ethyl]-2,10,11,12,13,15-hexahydropyrazolo[4',3':9,10][1,6]oxazacycloundecino[8,7,6-hi]indole-8-carboxylic acid |
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![LRL LRL](https://data.pdbj.org/pdbjplus/data/cc/svg/LRL.svg) | LRL | Name: | ~{N}-[[(2~{S},5~{R})-5-(4-pyridin-3-ylphenyl)pyrrolidin-2-yl]methyl]isoquinoline-5-sulfonamide | Formula: | C25 H24 N4 O2 S | SMILES: | O=[S](=O)(NC[CH]1CC[CH](N1)c2ccc(cc2)c3cccnc3)c4cccc5cnccc45 | InChi: | InChI=1S/C25H24N4O2S/c30-32(31,25-5-1-3-21-16-27-14-12-23(21)25)28-17-22-10-11-24(29-22)19-8-6-18(7-9-19)20-4-2-13-26-15-20/h1-9,12-16,22,24,28-29H,10-11,17H2/t22-,24+/m0/s1 | Definition date: | 2022-07-11 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | ~{N}-[[(2~{S},5~{R})-5-(4-pyridin-3-ylphenyl)pyrrolidin-2-yl]methyl]isoquinoline-5-sulfonamide |
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![7IO 7IO](https://data.pdbj.org/pdbjplus/data/cc/svg/7IO.svg) | 7IO | Name: | 6-(4-piperazin-1-ylphenyl)-3-quinolin-4-yl-furo[3,2-b]pyridine | Formula: | C26 H22 N4 O | SMILES: | C1CN(CCN1)c2ccc(cc2)c3cnc4c(occ4c5ccnc6ccccc56)c3 | InChi: | InChI=1S/C26H22N4O/c1-2-4-24-22(3-1)21(9-10-28-24)23-17-31-25-15-19(16-29-26(23)25)18-5-7-20(8-6-18)30-13-11-27-12-14-30/h1-10,15-17,27H,11-14H2 | Definition date: | 2023-07-12 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 6-(4-piperazin-1-ylphenyl)-3-quinolin-4-yl-furo[3,2-b]pyridine |
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![NI4 NI4](https://data.pdbj.org/pdbjplus/data/cc/svg/NI4.svg) | NI4 | Name: | (5~{Z})-5-[[4-[2-hydroxyethyl(methyl)amino]phenyl]methylidene]-3-methyl-2-[(~{E})-2-phenylethenyl]imidazol-4-one | Formula: | C22 H23 N3 O2 | SMILES: | CN(CCO)c1ccc(cc1)C=C2N=C(C=Cc3ccccc3)N(C)C2=O | InChi: | InChI=1S/C22H23N3O2/c1-24(14-15-26)19-11-8-18(9-12-19)16-20-22(27)25(2)21(23-20)13-10-17-6-4-3-5-7-17/h3-13,16,26H,14-15H2,1-2H3/b13-10+,20-16- | Definition date: | 2023-01-17 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | (5~{Z})-5-[[4-[2-hydroxyethyl(methyl)amino]phenyl]methylidene]-3-methyl-2-[(~{E})-2-phenylethenyl]imidazol-4-one |
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![NJL NJL](https://data.pdbj.org/pdbjplus/data/cc/svg/NJL.svg) | NJL | Name: | (5~{Z})-5-[[3,5-bis(fluoranyl)-4-oxidanyl-phenyl]methylidene]-2-[(~{E})-2-(4-hydroxyphenyl)ethenyl]-3-methyl-imidazol-4-one | Formula: | C19 H14 F2 N2 O3 | SMILES: | CN1C(=O)C(=Cc2cc(F)c(O)c(F)c2)N=C1C=Cc3ccc(O)cc3 | InChi: | InChI=1S/C19H14F2N2O3/c1-23-17(7-4-11-2-5-13(24)6-3-11)22-16(19(23)26)10-12-8-14(20)18(25)15(21)9-12/h2-10,24-25H,1H3/b7-4+,16-10- | Definition date: | 2023-01-17 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | (5~{Z})-5-[[3,5-bis(fluoranyl)-4-oxidanyl-phenyl]methylidene]-2-[(~{E})-2-(4-hydroxyphenyl)ethenyl]-3-methyl-imidazol-4-one |
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![O00 O00](https://data.pdbj.org/pdbjplus/data/cc/svg/O00.svg) | O00 | Name: | (5~{Z})-5-[[3,5-bis(fluoranyl)-4-oxidanyl-phenyl]methylidene]-3-methyl-2-[(~{E})-2-phenylethenyl]imidazol-4-one | Formula: | C19 H14 F2 N2 O2 | SMILES: | CN1C(=O)C(=Cc2cc(F)c(O)c(F)c2)N=C1C=Cc3ccccc3 | InChi: | InChI=1S/C19H14F2N2O2/c1-23-17(8-7-12-5-3-2-4-6-12)22-16(19(23)25)11-13-9-14(20)18(24)15(21)10-13/h2-11,24H,1H3/b8-7+,16-11- | Definition date: | 2023-01-20 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | (5~{Z})-5-[[3,5-bis(fluoranyl)-4-oxidanyl-phenyl]methylidene]-3-methyl-2-[(~{E})-2-phenylethenyl]imidazol-4-one |
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![O2I O2I](https://data.pdbj.org/pdbjplus/data/cc/svg/O2I.svg) | O2I | Name: | 4-[(~{E})-2-[(4~{Z})-4-[[3,5-bis(fluoranyl)-4-oxidanyl-phenyl]methylidene]-1-methyl-5-oxidanylidene-imidazol-2-yl]ethenyl]benzenecarbonitrile | Formula: | C20 H13 F2 N3 O2 | SMILES: | CN1C(=O)C(=Cc2cc(F)c(O)c(F)c2)N=C1C=Cc3ccc(cc3)C#N | InChi: | InChI=1S/C20H13F2N3O2/c1-25-18(7-6-12-2-4-13(11-23)5-3-12)24-17(20(25)27)10-14-8-15(21)19(26)16(22)9-14/h2-10,26H,1H3/b7-6+,17-10- | Definition date: | 2023-01-20 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 4-[(~{E})-2-[(4~{Z})-4-[[3,5-bis(fluoranyl)-4-oxidanyl-phenyl]methylidene]-1-methyl-5-oxidanylidene-imidazol-2-yl]ethenyl]benzenecarbonitrile |
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![SOU SOU](https://data.pdbj.org/pdbjplus/data/cc/svg/SOU.svg) | SOU | Name: | [(2E)-3,7-dimethylocta-2,6-dienyl] ethanoate | Formula: | C12 H20 O2 | SMILES: | CC(=O)OCC=C(C)CCC=C(C)C | InChi: | InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8+ | Definition date: | 2023-04-13 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | [(2~{E})-3,7-dimethylocta-2,6-dienyl] ethanoate |
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![G3Y G3Y](https://data.pdbj.org/pdbjplus/data/cc/svg/G3Y.svg) | G3Y | Name: | (1~{R},2~{S},3~{S},4~{R},5~{S})-2-azanyl-4-phenylsulfanyl-6,8-dioxabicyclo[3.2.1]octan-3-ol | Formula: | C12 H15 N O3 S | SMILES: | N[CH]1[CH]2CO[CH](O2)[CH](Sc3ccccc3)[CH]1O | InChi: | InChI=1S/C12H15NO3S/c13-9-8-6-15-12(16-8)11(10(9)14)17-7-4-2-1-3-5-7/h1-5,8-12,14H,6,13H2/t8-,9+,10-,11+,12-/m0/s1 | Definition date: | 2021-12-16 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | (1~{R},2~{S},3~{S},4~{R},5~{S})-2-azanyl-4-phenylsulfanyl-6,8-dioxabicyclo[3.2.1]octan-3-ol |
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![A1ASN A1ASN](https://data.pdbj.org/pdbjplus/data/cc/svg/A1ASN.svg) | A1ASN | Name: | [(1'R)-6'-hydroxy-1'-{4-[(1-propylazetidin-3-yl)methoxy]phenyl}-1',4'-dihydro-2'H-spiro[cyclopropane-1,3'-isoquinolin]-2'-yl](phenyl)methanone | Formula: | C31 H34 N2 O3 | SMILES: | CCCN1CC(C1)COc1ccc(cc1)C1c2ccc(O)cc2CC2(CC2)N1C(=O)c1ccccc1 | InChi: | InChI=1S/C31H34N2O3/c1-2-16-32-19-22(20-32)21-36-27-11-8-23(9-12-27)29-28-13-10-26(34)17-25(28)18-31(14-15-31)33(29)30(35)24-6-4-3-5-7-24/h3-13,17,22,29,34H,2,14-16,18-21H2,1H3/t29-/m1/s1 | Definition date: | 2024-05-20 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | [(1'R)-6'-hydroxy-1'-{4-[(1-propylazetidin-3-yl)methoxy]phenyl}-1',4'-dihydro-2'H-spiro[cyclopropane-1,3'-isoquinolin]-2'-yl](phenyl)methanone |
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![A1AU0 A1AU0](https://data.pdbj.org/pdbjplus/data/cc/svg/A1AU0.svg) | A1AU0 | Name: | (2R)-2-phenoxy-3-{[(1S,2S,4S)-spiro[bicyclo[2.2.1]heptane-7,1'-cyclopropane]-2-carbonyl]amino}propanoic acid | Formula: | C19 H23 N O4 | SMILES: | O=C(O)C(Oc1ccccc1)CNC(=O)C1CC2CCC1C12CC1 | InChi: | InChI=1S/C19H23NO4/c21-17(14-10-12-6-7-15(14)19(12)8-9-19)20-11-16(18(22)23)24-13-4-2-1-3-5-13/h1-5,12,14-16H,6-11H2,(H,20,21)(H,22,23)/t12-,14?,15-,16+/m0/s1 | Definition date: | 2024-06-12 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | (2R)-2-phenoxy-3-{[(1S,2S,4S)-spiro[bicyclo[2.2.1]heptane-7,1'-cyclopropane]-2-carbonyl]amino}propanoic acid |
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![A1AU1 A1AU1](https://data.pdbj.org/pdbjplus/data/cc/svg/A1AU1.svg) | A1AU1 | Name: | 3,5-dichloro-N-(8-fluoroisoquinolin-5-yl)-2-hydroxybenzene-1-sulfonamide | Formula: | C15 H9 Cl2 F N2 O3 S | SMILES: | Clc1cc(c(O)c(Cl)c1)S(=O)(=O)Nc1ccc(F)c2cnccc21 | InChi: | InChI=1S/C15H9Cl2FN2O3S/c16-8-5-11(17)15(21)14(6-8)24(22,23)20-13-2-1-12(18)10-7-19-4-3-9(10)13/h1-7,20-21H | Definition date: | 2024-06-12 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 3,5-dichloro-N-(8-fluoroisoquinolin-5-yl)-2-hydroxybenzene-1-sulfonamide |
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![A1AU5 A1AU5](https://data.pdbj.org/pdbjplus/data/cc/svg/A1AU5.svg) | A1AU5 | Name: | N-(1-acetyl-2,3-dihydro-1H-indol-4-yl)-3-chloro-2-hydroxybenzene-1-sulfonamide | Formula: | C16 H15 Cl N2 O4 S | SMILES: | Clc1cccc(c1O)S(=O)(=O)Nc1cccc2c1CCN2C(C)=O | InChi: | InChI=1S/C16H15ClN2O4S/c1-10(20)19-9-8-11-13(5-3-6-14(11)19)18-24(22,23)15-7-2-4-12(17)16(15)21/h2-7,18,21H,8-9H2,1H3 | Definition date: | 2024-06-13 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | N-(1-acetyl-2,3-dihydro-1H-indol-4-yl)-3-chloro-2-hydroxybenzene-1-sulfonamide |
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![A1AUT A1AUT](https://data.pdbj.org/pdbjplus/data/cc/svg/A1AUT.svg) | A1AUT | Name: | 3-chloro-N-(5-chloro-2-methyl-1,3-benzothiazol-6-yl)-2-hydroxybenzene-1-sulfonamide | Formula: | C14 H10 Cl2 N2 O3 S2 | SMILES: | Clc1cccc(c1O)S(=O)(=O)Nc1cc2sc(C)nc2cc1Cl | InChi: | InChI=1S/C14H10Cl2N2O3S2/c1-7-17-11-5-9(16)10(6-12(11)22-7)18-23(20,21)13-4-2-3-8(15)14(13)19/h2-6,18-19H,1H3 | Definition date: | 2024-06-10 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 3-chloro-N-(5-chloro-2-methyl-1,3-benzothiazol-6-yl)-2-hydroxybenzene-1-sulfonamide |
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![A1AUZ A1AUZ](https://data.pdbj.org/pdbjplus/data/cc/svg/A1AUZ.svg) | A1AUZ | Name: | N-[(3M)-3-(5-chloro-1,2,3-thiadiazol-4-yl)phenyl]-5-methyl-3-oxo-2,3-dihydro-1,2-oxazole-4-sulfonamide | Formula: | C12 H9 Cl N4 O4 S2 | SMILES: | CC=1ONC(=O)C=1S(=O)(=O)Nc1cccc(c1)c1nnsc1Cl | InChi: | InChI=1S/C12H9ClN4O4S2/c1-6-10(12(18)15-21-6)23(19,20)16-8-4-2-3-7(5-8)9-11(13)22-17-14-9/h2-5,16H,1H3,(H,15,18) | Definition date: | 2024-06-12 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | N-[(3M)-3-(5-chloro-1,2,3-thiadiazol-4-yl)phenyl]-5-methyl-3-oxo-2,3-dihydro-1,2-oxazole-4-sulfonamide |
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![A1D8M A1D8M](https://data.pdbj.org/pdbjplus/data/cc/svg/A1D8M.svg) | A1D8M | Name: | 4-[5-[(1~{R})-1-(4-cyclopropylcarbonylphenoxy)propyl]-1,2,4-oxadiazol-3-yl]-2-fluoranyl-~{N}-[(2~{R})-1-oxidanylpropan-2-yl]benzamide | Formula: | C25 H26 F N3 O5 | SMILES: | CC[CH](Oc1ccc(cc1)C(=O)C2CC2)c3onc(n3)c4ccc(C(=O)N[CH](C)CO)c(F)c4 | InChi: | InChI=1S/C25H26FN3O5/c1-3-21(33-18-9-6-16(7-10-18)22(31)15-4-5-15)25-28-23(29-34-25)17-8-11-19(20(26)12-17)24(32)27-14(2)13-30/h6-12,14-15,21,30H,3-5,13H2,1-2H3,(H,27,32)/t14-,21-/m1/s1 | Synonyms: | Firuglipel | Definition date: | 2024-06-04 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 4-[5-[(1~{R})-1-(4-cyclopropylcarbonylphenoxy)propyl]-1,2,4-oxadiazol-3-yl]-2-fluoranyl-~{N}-[(2~{R})-1-oxidanylpropan-2-yl]benzamide |
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![A1D8Y A1D8Y](https://data.pdbj.org/pdbjplus/data/cc/svg/A1D8Y.svg) | A1D8Y | Name: | 5-[4-[[6-(4-methylsulfonylphenyl)pyridin-3-yl]oxymethyl]piperidin-1-yl]-3-propan-2-yl-1,2,4-oxadiazole | Formula: | C23 H28 N4 O4 S | SMILES: | CC(C)c1noc(n1)N2CCC(CC2)COc3ccc(nc3)c4ccc(cc4)[S](C)(=O)=O | InChi: | InChI=1S/C23H28N4O4S/c1-16(2)22-25-23(31-26-22)27-12-10-17(11-13-27)15-30-19-6-9-21(24-14-19)18-4-7-20(8-5-18)32(3,28)29/h4-9,14,16-17H,10-13,15H2,1-3H3 | Synonyms: | GSK1292263 | Definition date: | 2024-06-07 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 5-[4-[[6-(4-methylsulfonylphenyl)pyridin-3-yl]oxymethyl]piperidin-1-yl]-3-propan-2-yl-1,2,4-oxadiazole |
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![A1H0G A1H0G](https://data.pdbj.org/pdbjplus/data/cc/svg/A1H0G.svg) | A1H0G | Name: | 1-benzothiophen-5-amine | Formula: | C8 H7 N S | SMILES: | Nc1ccc2sccc2c1 | InChi: | InChI=1S/C8H7NS/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5H,9H2 | Definition date: | 2023-12-15 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 1-benzothiophen-5-amine |
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![A1H0M A1H0M](https://data.pdbj.org/pdbjplus/data/cc/svg/A1H0M.svg) | A1H0M | Name: | 6-bromanyl-1,3-benzothiazol-2-amine | Formula: | C7 H5 Br N2 S | SMILES: | Nc1sc2cc(Br)ccc2n1 | InChi: | InChI=1S/C7H5BrN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10) | Definition date: | 2023-12-15 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 6-bromanyl-1,3-benzothiazol-2-amine |
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![A1H0N A1H0N](https://data.pdbj.org/pdbjplus/data/cc/svg/A1H0N.svg) | A1H0N | Name: | (1~{R})-1-(4-bromophenyl)ethanamine | Formula: | C8 H10 Br N | SMILES: | C[CH](N)c1ccc(Br)cc1 | InChi: | InChI=1S/C8H10BrN/c1-6(10)7-2-4-8(9)5-3-7/h2-6H,10H2,1H3/t6-/m1/s1 | Definition date: | 2023-12-15 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | (1~{R})-1-(4-bromophenyl)ethanamine |
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![A1H1S A1H1S](https://data.pdbj.org/pdbjplus/data/cc/svg/A1H1S.svg) | A1H1S | Name: | 2-azanyl-4-(4-hydroxyphenyl)-6-(1~{H}-imidazol-2-ylmethylsulfanyl)pyridine-3,5-dicarbonitrile | Formula: | C17 H12 N6 O S | SMILES: | Nc1nc(SCc2[nH]ccn2)c(C#N)c(c3ccc(O)cc3)c1C#N | InChi: | InChI=1S/C17H12N6OS/c18-7-12-15(10-1-3-11(24)4-2-10)13(8-19)17(23-16(12)20)25-9-14-21-5-6-22-14/h1-6,24H,9H2,(H2,20,23)(H,21,22) | Definition date: | 2024-01-03 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 2-azanyl-4-(4-hydroxyphenyl)-6-(1~{H}-imidazol-2-ylmethylsulfanyl)pyridine-3,5-dicarbonitrile |
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![A1AEU A1AEU](https://data.pdbj.org/pdbjplus/data/cc/svg/A1AEU.svg) | A1AEU | Name: | 1-methyl-1'-[(oxan-4-yl)methyl]-5-(trifluoromethyl)spiro[indole-2,4'-piperidin]-3(1H)-one | Formula: | C20 H25 F3 N2 O2 | SMILES: | FC(F)(F)c1cc2C(=O)C3(CCN(CC3)CC3CCOCC3)N(C)c2cc1 | InChi: | InChI=1S/C20H25F3N2O2/c1-24-17-3-2-15(20(21,22)23)12-16(17)18(26)19(24)6-8-25(9-7-19)13-14-4-10-27-11-5-14/h2-3,12,14H,4-11,13H2,1H3 | Definition date: | 2024-02-15 | Last modified: | 2024-06-14 | Release date: | 2024-06-19 | Identifier: | 1-methyl-1'-[(oxan-4-yl)methyl]-5-(trifluoromethyl)spiro[indole-2,4'-piperidin]-3(1H)-one |
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