Name: Ribociclib succinate hydrate
Rating: 5 (10 reviews)

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HIT ID:HIT214433520
Cas No:1374639-79-8
常用名:Ribociclib succinate hydrate
别名:LEE011 succinate hydrate
IUPAC:7-cyclopentyl-N,N-dimethyl-2-{[5-(piperazin-1-yl)pyridin-2-yl]amino}-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide butanedioic acid hydrate
IUPAC:7-cyclopentyl-N,N-dimethyl-2-{[5-(piperazin-1-yl)pyridin-2-yl]amino}-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide butanedioic acid hydrate
InChI key:PZJOFPMHNJJJSC-UHFFFAOYSA-N

分子式:C27H38N8O6
分子量:570.651
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:O.OC(=O)CCC(O)=O.CN(C)C(=O)c1cc2cnc(Nc3ccc(cn3)N3CCNCC3)nc2n1C1CCCC1
SMILES:O.OC(=O)CCC(O)=O.CN(C)C(=O)c1cc2cnc(Nc3ccc(cn3)N3CCNCC3)nc2n1C1CCCC1

Ribociclib succinate hydrate is a highly specific CDK4/6 inhibitor (IC50s: 10 nM and 39 nM, respectively). It also is over 1,000-fold less potent against the cyclin B/CDK1 complex.

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