Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LGXI10
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| Ligand Name |
3-(2,6-dichloro-3,5-dimethoxyphenyl)-1-{(3S)-1-[(2E)-4-(dimethylamino)but-2-enoyl]pyrrolidin-3-yl}-7-[(propan-2-yl)amino]-3,4-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
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| Synonyms |
3-(2,6-dichloro-3,5-dimethoxyphenyl)-1-{(3S)-1-[(2E)-4-(dimethylamino)but-2-enoyl]pyrrolidin-3-yl}-7-[(propan-2-yl)amino]-3,4-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one; SCHEMBL20486741
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| Structure |
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Download2D MOL |
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| Formula |
C27H35Cl2N7O4
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| Canonical SMILES |
CC(C)NC1=NC=C2CN(C(=O)N(C2=N1)C3CCN(C3)C(=O)C=CCN(C)C)C4=C(C(=CC(=C4Cl)OC)OC)Cl
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| InChI |
1S/C27H35Cl2N7O4/c1-16(2)31-26-30-13-17-14-35(24-22(28)19(39-5)12-20(40-6)23(24)29)27(38)36(25(17)32-26)18-9-11-34(15-18)21(37)8-7-10-33(3)4/h7-8,12-13,16,18H,9-11,14-15H2,1-6H3,(H,30,31,32)/b8-7+/t18-/m0/s1
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| InChIKey |
YDGYWUOFQSHNPV-DVBCCOPCSA-N
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| PubChem Compound ID | ||||
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