PROTAC CDK4/6 degrader 1
HIT218850437
sdf文件结构编辑类似物检索
HIT ID: HIT218850437
Cas No:
分子式: C41H47N11O6
分子量: 789.898
常用名: PROTAC CDK4/6 degrader 1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 5-(4-{4-[(8-cyclopentyl-7-oxo-7,8-dihydropteridin-2-yl)amino]phenyl}piperazin-1-yl)-N-(2-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}ethyl)pentanamide
IUPAC: 5-(4-{4-[(8-cyclopentyl-7-oxo-7,8-dihydropteridin-2-yl)amino]phenyl}piperazin-1-yl)-N-(2-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}ethyl)pentanamide
SMILES: O=C(CCCCN1CCN(CC1)c1ccc(Nc2ncc3ncc(=O)n(C4CCCC4)c3n2)cc1)NCCNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12
SMILES: O=C(CCCCN1CCN(CC1)c1ccc(Nc2ncc3ncc(=O)n(C4CCCC4)c3n2)cc1)NCCNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12
InChI key: ITSRILWBOAUMKU-UHFFFAOYSA-N
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