![I8J I8J](https://data.pdbj.org/pdbjplus/data/cc/svg/I8J.svg) | I8J | Name: | 5-fluoro-1-(1-methylcyclopropane-1-sulfonyl)-1,2,3,6-tetrahydropyridine | Formula: | C9 H14 F N O2 S | SMILES: | FC=1CN(CCC=1)S(=O)(=O)C1(C)CC1 | InChi: | InChI=1S/C9H14FNO2S/c1-9(4-5-9)14(12,13)11-6-2-3-8(10)7-11/h3H,2,4-7H2,1H3 | Definition date: | 2022-01-21 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 5-fluoro-1-(1-methylcyclopropane-1-sulfonyl)-1,2,3,6-tetrahydropyridine |
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![I8M I8M](https://data.pdbj.org/pdbjplus/data/cc/svg/I8M.svg) | I8M | Name: | 2-[(morpholin-4-yl)methyl]phenol | Formula: | C11 H15 N O2 | SMILES: | Oc1ccccc1CN1CCOCC1 | InChi: | InChI=1S/C11H15NO2/c13-11-4-2-1-3-10(11)9-12-5-7-14-8-6-12/h1-4,13H,5-9H2 | Definition date: | 2022-01-21 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 2-[(morpholin-4-yl)methyl]phenol |
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![IRR IRR](https://data.pdbj.org/pdbjplus/data/cc/svg/IRR.svg) | IRR | Name: | N-{(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-N~2~-({[(1R,2R)-2-propylcyclopropyl]methoxy}carbonyl)-L-leucinamide | Formula: | C21 H35 N3 O5 | SMILES: | CC(C)CC(NC(=O)OCC1CC1CCC)C(=O)NC(CC1CCNC1=O)C=O | InChi: | InChI=1S/C21H35N3O5/c1-4-5-14-9-16(14)12-29-21(28)24-18(8-13(2)3)20(27)23-17(11-25)10-15-6-7-22-19(15)26/h11,13-18H,4-10,12H2,1-3H3,(H,22,26)(H,23,27)(H,24,28)/t14-,15+,16+,17+,18+/m1/s1 | Definition date: | 2022-01-27 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | N-{(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-N~2~-({[(1R,2R)-2-propylcyclopropyl]methoxy}carbonyl)-L-leucinamide |
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![IRW IRW](https://data.pdbj.org/pdbjplus/data/cc/svg/IRW.svg) | IRW | Name: | (1S,2S)-1-hydroxy-2-{[N-({[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]methoxy}carbonyl)-L-leucyl]amino}-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid | Formula: | C25 H37 N3 O9 S | SMILES: | COc1ccc(cc1)C1CC1COC(=O)NC(CC(C)C)C(=O)NC(CC1CCNC1=O)C(O)S(=O)(=O)O | InChi: | InChI=1S/C25H37N3O9S/c1-14(2)10-20(23(30)27-21(24(31)38(33,34)35)12-16-8-9-26-22(16)29)28-25(32)37-13-17-11-19(17)15-4-6-18(36-3)7-5-15/h4-7,14,16-17,19-21,24,31H,8-13H2,1-3H3,(H,26,29)(H,27,30)(H,28,32)(H,33,34,35)/t16-,17-,19-,20-,21-,24-/m0/s1 | Definition date: | 2022-01-27 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | (1S,2S)-1-hydroxy-2-{[N-({[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]methoxy}carbonyl)-L-leucyl]amino}-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid |
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![IT3 IT3](https://data.pdbj.org/pdbjplus/data/cc/svg/IT3.svg) | IT3 | Name: | (1S,2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]-2-{[N-({[(1R,2R)-2-propylcyclopropyl]methoxy}carbonyl)-L-leucyl]amino}propane-1-sulfonic acid | Formula: | C21 H37 N3 O8 S | SMILES: | CC(C)CC(NC(=O)OCC1CC1CCC)C(=O)NC(CC1CCNC1=O)C(O)S(=O)(=O)O | InChi: | InChI=1S/C21H37N3O8S/c1-4-5-13-9-15(13)11-32-21(28)24-16(8-12(2)3)19(26)23-17(20(27)33(29,30)31)10-14-6-7-22-18(14)25/h12-17,20,27H,4-11H2,1-3H3,(H,22,25)(H,23,26)(H,24,28)(H,29,30,31)/t13-,14+,15+,16+,17+,20+/m1/s1 | Definition date: | 2022-01-27 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | (1S,2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]-2-{[N-({[(1R,2R)-2-propylcyclopropyl]methoxy}carbonyl)-L-leucyl]amino}propane-1-sulfonic acid |
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![ITG ITG](https://data.pdbj.org/pdbjplus/data/cc/svg/ITG.svg) | ITG | Name: | (1R,2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]-2-{[N-({[(1R,2R)-2-propylcyclopropyl]methoxy}carbonyl)-L-leucyl]amino}propane-1-sulfonic acid | Formula: | C21 H37 N3 O8 S | SMILES: | CC(C)CC(NC(=O)OCC1CC1CCC)C(=O)NC(CC1CCNC1=O)C(O)S(=O)(=O)O | InChi: | InChI=1S/C21H37N3O8S/c1-4-5-13-9-15(13)11-32-21(28)24-16(8-12(2)3)19(26)23-17(20(27)33(29,30)31)10-14-6-7-22-18(14)25/h12-17,20,27H,4-11H2,1-3H3,(H,22,25)(H,23,26)(H,24,28)(H,29,30,31)/t13-,14+,15+,16+,17+,20-/m1/s1 | Definition date: | 2022-01-27 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | (1R,2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]-2-{[N-({[(1R,2R)-2-propylcyclopropyl]methoxy}carbonyl)-L-leucyl]amino}propane-1-sulfonic acid |
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![ITX ITX](https://data.pdbj.org/pdbjplus/data/cc/svg/ITX.svg) | ITX | Name: | (1R,2S)-1-hydroxy-2-{[N-({[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]methoxy}carbonyl)-L-leucyl]amino}-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid | Formula: | C25 H37 N3 O9 S | SMILES: | COc1ccc(cc1)C1CC1COC(=O)NC(CC(C)C)C(=O)NC(CC1CCNC1=O)C(O)S(=O)(=O)O | InChi: | InChI=1S/C25H37N3O9S/c1-14(2)10-20(23(30)27-21(24(31)38(33,34)35)12-16-8-9-26-22(16)29)28-25(32)37-13-17-11-19(17)15-4-6-18(36-3)7-5-15/h4-7,14,16-17,19-21,24,31H,8-13H2,1-3H3,(H,26,29)(H,27,30)(H,28,32)(H,33,34,35)/t16-,17-,19-,20-,21-,24+/m0/s1 | Definition date: | 2022-01-27 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | (1R,2S)-1-hydroxy-2-{[N-({[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]methoxy}carbonyl)-L-leucyl]amino}-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid |
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![GQO GQO](https://data.pdbj.org/pdbjplus/data/cc/svg/GQO.svg) | GQO | Name: | 2-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-N,N-dimethylethane-1-sulfonamide | Formula: | C19 H29 N5 O4 S | SMILES: | CCc1nc(N)nc(N)c1OCCCOc1ccccc1CCS(=O)(=O)N(C)C | InChi: | InChI=1S/C19H29N5O4S/c1-4-15-17(18(20)23-19(21)22-15)28-12-7-11-27-16-9-6-5-8-14(16)10-13-29(25,26)24(2)3/h5-6,8-9H,4,7,10-13H2,1-3H3,(H4,20,21,22,23) | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 2-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-N,N-dimethylethane-1-sulfonamide |
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![GUU GUU](https://data.pdbj.org/pdbjplus/data/cc/svg/GUU.svg) | GUU | Name: | 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-N-(methanesulfonyl)propanamide | Formula: | C19 H27 N5 O5 S | SMILES: | CCc1nc(N)nc(N)c1OCCCOc1ccccc1CCC(=O)NS(C)(=O)=O | InChi: | InChI=1S/C19H27N5O5S/c1-3-14-17(18(20)23-19(21)22-14)29-12-6-11-28-15-8-5-4-7-13(15)9-10-16(25)24-30(2,26)27/h4-5,7-8H,3,6,9-12H2,1-2H3,(H,24,25)(H4,20,21,22,23) | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-N-(methanesulfonyl)propanamide |
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![GWL GWL](https://data.pdbj.org/pdbjplus/data/cc/svg/GWL.svg) | GWL | Name: | 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)propanamide | Formula: | C18 H25 N5 O3 | SMILES: | CCc1nc(N)nc(N)c1OCCCOc1ccccc1CCC(N)=O | InChi: | InChI=1S/C18H25N5O3/c1-2-13-16(17(20)23-18(21)22-13)26-11-5-10-25-14-7-4-3-6-12(14)8-9-15(19)24/h3-4,6-7H,2,5,8-11H2,1H3,(H2,19,24)(H4,20,21,22,23) | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)propanamide |
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![GXC GXC](https://data.pdbj.org/pdbjplus/data/cc/svg/GXC.svg) | GXC | Name: | N-[2-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)ethanesulfonyl]acetamide | Formula: | C19 H27 N5 O5 S | SMILES: | CCc1nc(N)nc(N)c1OCCCOc1ccccc1CCS(=O)(=O)NC(C)=O | InChi: | InChI=1S/C19H27N5O5S/c1-3-15-17(18(20)23-19(21)22-15)29-11-6-10-28-16-8-5-4-7-14(16)9-12-30(26,27)24-13(2)25/h4-5,7-8H,3,6,9-12H2,1-2H3,(H,24,25)(H4,20,21,22,23) | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | N-[2-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)ethanesulfonyl]acetamide |
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![GXJ GXJ](https://data.pdbj.org/pdbjplus/data/cc/svg/GXJ.svg) | GXJ | Name: | (2R)-3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-2-methylpropanoic acid | Formula: | C19 H26 N4 O4 | SMILES: | CCc1nc(N)nc(N)c1OCCCOc1ccccc1CC(C)C(=O)O | InChi: | InChI=1S/C19H26N4O4/c1-3-14-16(17(20)23-19(21)22-14)27-10-6-9-26-15-8-5-4-7-13(15)11-12(2)18(24)25/h4-5,7-8,12H,3,6,9-11H2,1-2H3,(H,24,25)(H4,20,21,22,23)/t12-/m1/s1 | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | (2R)-3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-2-methylpropanoic acid |
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![GYI GYI](https://data.pdbj.org/pdbjplus/data/cc/svg/GYI.svg) | GYI | Name: | 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-N-(propane-2-sulfonyl)propanamide | Formula: | C21 H31 N5 O5 S | SMILES: | CCc1nc(N)nc(N)c1OCCCOc1ccccc1CCC(=O)NS(=O)(=O)C(C)C | InChi: | InChI=1S/C21H31N5O5S/c1-4-16-19(20(22)25-21(23)24-16)31-13-7-12-30-17-9-6-5-8-15(17)10-11-18(27)26-32(28,29)14(2)3/h5-6,8-9,14H,4,7,10-13H2,1-3H3,(H,26,27)(H4,22,23,24,25) | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-N-(propane-2-sulfonyl)propanamide |
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![H03 H03](https://data.pdbj.org/pdbjplus/data/cc/svg/H03.svg) | H03 | Name: | 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-N-(dimethylsulfamoyl)propanamide | Formula: | C20 H30 N6 O5 S | SMILES: | CCc1nc(N)nc(N)c1OCCCOc1ccccc1CCC(=O)NS(=O)(=O)N(C)C | InChi: | InChI=1S/C20H30N6O5S/c1-4-15-18(19(21)24-20(22)23-15)31-13-7-12-30-16-9-6-5-8-14(16)10-11-17(27)25-32(28,29)26(2)3/h5-6,8-9H,4,7,10-13H2,1-3H3,(H,25,27)(H4,21,22,23,24) | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-N-(dimethylsulfamoyl)propanamide |
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![H0I H0I](https://data.pdbj.org/pdbjplus/data/cc/svg/H0I.svg) | H0I | Name: | 4-(3-{4-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]butoxy}phenyl)butanoic acid | Formula: | C20 H28 N4 O4 | SMILES: | CCc1nc(N)nc(N)c1OCCCCOc1cc(CCCC(=O)O)ccc1 | InChi: | InChI=1S/C20H28N4O4/c1-2-16-18(19(21)24-20(22)23-16)28-12-4-3-11-27-15-9-5-7-14(13-15)8-6-10-17(25)26/h5,7,9,13H,2-4,6,8,10-12H2,1H3,(H,25,26)(H4,21,22,23,24) | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 4-(3-{4-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]butoxy}phenyl)butanoic acid |
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![GHU GHU](https://data.pdbj.org/pdbjplus/data/cc/svg/GHU.svg) | GHU | Name: | ethyl 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)propanoate | Formula: | C20 H28 N4 O4 | SMILES: | CCc1nc(N)nc(N)c1OCCCOc1ccccc1CCC(=O)OCC | InChi: | InChI=1S/C20H28N4O4/c1-3-15-18(19(21)24-20(22)23-15)28-13-7-12-27-16-9-6-5-8-14(16)10-11-17(25)26-4-2/h5-6,8-9H,3-4,7,10-13H2,1-2H3,(H4,21,22,23,24) | Definition date: | 2021-12-21 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | ethyl 3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)propanoate |
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![GI6 GI6](https://data.pdbj.org/pdbjplus/data/cc/svg/GI6.svg) | GI6 | Name: | (2R)-3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-2-methylpropanamide | Formula: | C19 H27 N5 O3 | SMILES: | CCc1nc(N)nc(N)c1OCCCOc1ccccc1CC(C)C(N)=O | InChi: | InChI=1S/C19H27N5O3/c1-3-14-16(17(20)24-19(22)23-14)27-10-6-9-26-15-8-5-4-7-13(15)11-12(2)18(21)25/h4-5,7-8,12H,3,6,9-11H2,1-2H3,(H2,21,25)(H4,20,22,23,24)/t12-/m1/s1 | Definition date: | 2021-12-21 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | (2R)-3-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)-2-methylpropanamide |
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![81O 81O](https://data.pdbj.org/pdbjplus/data/cc/svg/81O.svg) | 81O | Name: | 5-[4-butoxy-3-[[[2-fluoranyl-4-(trifluoromethyl)phenyl]carbonylamino]methyl]phenyl]-4,6-dimethyl-pyridine-3-carboxylic acid | Formula: | C27 H26 F4 N2 O4 | SMILES: | CCCCOc1ccc(cc1CNC(=O)c2ccc(cc2F)C(F)(F)F)c3c(C)ncc(C(O)=O)c3C | InChi: | InChI=1S/C27H26F4N2O4/c1-4-5-10-37-23-9-6-17(24-15(2)21(26(35)36)14-32-16(24)3)11-18(23)13-33-25(34)20-8-7-19(12-22(20)28)27(29,30)31/h6-9,11-12,14H,4-5,10,13H2,1-3H3,(H,33,34)(H,35,36) | Definition date: | 2021-11-12 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 5-[4-butoxy-3-[[[2-fluoranyl-4-(trifluoromethyl)phenyl]carbonylamino]methyl]phenyl]-4,6-dimethyl-pyridine-3-carboxylic acid |
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![820 820](https://data.pdbj.org/pdbjplus/data/cc/svg/820.svg) | 820 | Name: | (2S)-2-[[4-propoxy-3-[[[4-(trifluoromethyl)phenyl]carbonylamino]methyl]phenyl]methyl]butanoic acid | Formula: | C23 H26 F3 N O4 | SMILES: | CCCOc1ccc(C[CH](CC)C(O)=O)cc1CNC(=O)c2ccc(cc2)C(F)(F)F | InChi: | InChI=1S/C23H26F3NO4/c1-3-11-31-20-10-5-15(12-16(4-2)22(29)30)13-18(20)14-27-21(28)17-6-8-19(9-7-17)23(24,25)26/h5-10,13,16H,3-4,11-12,14H2,1-2H3,(H,27,28)(H,29,30)/t16-/m0/s1 | Definition date: | 2021-11-15 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | (2~{S})-2-[[4-propoxy-3-[[[4-(trifluoromethyl)phenyl]carbonylamino]methyl]phenyl]methyl]butanoic acid |
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![82K 82K](https://data.pdbj.org/pdbjplus/data/cc/svg/82K.svg) | 82K | Name: | (2S)-2-[[4-hexoxy-3-[[[4-(trifluoromethyl)phenyl]carbonylamino]methyl]phenyl]methyl]butanoic acid | Formula: | C26 H32 F3 N O4 | SMILES: | CCCCCCOc1ccc(C[CH](CC)C(O)=O)cc1CNC(=O)c2ccc(cc2)C(F)(F)F | InChi: | InChI=1S/C26H32F3NO4/c1-3-5-6-7-14-34-23-13-8-18(15-19(4-2)25(32)33)16-21(23)17-30-24(31)20-9-11-22(12-10-20)26(27,28)29/h8-13,16,19H,3-7,14-15,17H2,1-2H3,(H,30,31)(H,32,33)/t19-/m0/s1 | Definition date: | 2021-11-15 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | (2~{S})-2-[[4-hexoxy-3-[[[4-(trifluoromethyl)phenyl]carbonylamino]methyl]phenyl]methyl]butanoic acid |
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![5Z9 5Z9](https://data.pdbj.org/pdbjplus/data/cc/svg/5Z9.svg) | 5Z9 | Name: | (2R)-2-methyl-2-oxidanyl-butanenitrile | Formula: | C5 H9 N O | SMILES: | CC[C](C)(O)C#N | InChi: | InChI=1S/C5H9NO/c1-3-5(2,7)4-6/h7H,3H2,1-2H3/t5-/m1/s1 | Definition date: | 2021-09-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | (2~{R})-2-methyl-2-oxidanyl-butanenitrile |
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![H4U H4U](https://data.pdbj.org/pdbjplus/data/cc/svg/H4U.svg) | H4U | Name: | 6-ethyl-5-(4-{3-[3-(1H-tetrazol-5-yl)propyl]phenoxy}butoxy)pyrimidine-2,4-diamine | Formula: | C20 H28 N8 O2 | SMILES: | CCc1nc(N)nc(N)c1OCCCCOc1cccc(CCCc2nnn[NH]2)c1 | InChi: | InChI=1S/C20H28N8O2/c1-2-16-18(19(21)24-20(22)23-16)30-12-4-3-11-29-15-9-5-7-14(13-15)8-6-10-17-25-27-28-26-17/h5,7,9,13H,2-4,6,8,10-12H2,1H3,(H4,21,22,23,24)(H,25,26,27,28) | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 6-ethyl-5-(4-{3-[3-(1H-tetrazol-5-yl)propyl]phenoxy}butoxy)pyrimidine-2,4-diamine |
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![H6O H6O](https://data.pdbj.org/pdbjplus/data/cc/svg/H6O.svg) | H6O | Name: | (2S)-4-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)butane-1,2-diol | Formula: | C19 H28 N4 O4 | SMILES: | CCc1nc(N)nc(N)c1OCCCOc1ccccc1CCC(O)CO | InChi: | InChI=1S/C19H28N4O4/c1-2-15-17(18(20)23-19(21)22-15)27-11-5-10-26-16-7-4-3-6-13(16)8-9-14(25)12-24/h3-4,6-7,14,24-25H,2,5,8-12H2,1H3,(H4,20,21,22,23)/t14-/m0/s1 | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | (2S)-4-(2-{3-[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]propoxy}phenyl)butane-1,2-diol |
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![H9I H9I](https://data.pdbj.org/pdbjplus/data/cc/svg/H9I.svg) | H9I | Name: | 3-{2-[(3-{[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]methyl}oxetan-3-yl)methoxy]phenyl}propanoic acid | Formula: | C20 H26 N4 O5 | SMILES: | O=C(O)CCc1ccccc1OCC1(COc2c(N)nc(N)nc2CC)COC1 | InChi: | InChI=1S/C20H26N4O5/c1-2-14-17(18(21)24-19(22)23-14)29-12-20(9-27-10-20)11-28-15-6-4-3-5-13(15)7-8-16(25)26/h3-6H,2,7-12H2,1H3,(H,25,26)(H4,21,22,23,24) | Definition date: | 2022-01-03 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 3-{2-[(3-{[(2,4-diamino-6-ethylpyrimidin-5-yl)oxy]methyl}oxetan-3-yl)methoxy]phenyl}propanoic acid |
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![B7L B7L](https://data.pdbj.org/pdbjplus/data/cc/svg/B7L.svg) | B7L | Name: | 2-({[(8R)-pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}methyl)-1-benzofuran-7-carboxylic acid | Formula: | C17 H12 N4 O4 | SMILES: | O=C(O)c1cccc2cc(CNC(=O)c3cnn4cccnc43)oc12 | InChi: | InChI=1S/C17H12N4O4/c22-16(13-9-20-21-6-2-5-18-15(13)21)19-8-11-7-10-3-1-4-12(17(23)24)14(10)25-11/h1-7,9H,8H2,(H,19,22)(H,23,24) | Definition date: | 2021-11-12 | Last modified: | 2022-02-04 | Release date: | 2022-02-09 | Identifier: | 2-({[(8R)-pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino}methyl)-1-benzofuran-7-carboxylic acid |
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