CDK4-IN-2
HIT218851149
sdf文件结构编辑类似物检索
HIT ID: HIT218851149
Cas No: 2380320-68-1
分子式: C22H26F2N6O4S
分子量: 508.54
常用名: CDK4-IN-2
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3R,4R)-4-[(4-{13-ethyl-6-fluoro-11-oxa-1,8-diazatricyclo[7.4.0.0^{2,7}]trideca-2,4,6,8-tetraen-4-yl}-5-fluoropyrimidin-2-yl)amino]-1-methanesulfonylpiperidin-3-ol
IUPAC: (3R,4R)-4-[(4-{13-ethyl-6-fluoro-11-oxa-1,8-diazatricyclo[7.4.0.0^{2,7}]trideca-2,4,6,8-tetraen-4-yl}-5-fluoropyrimidin-2-yl)amino]-1-methanesulfonylpiperidin-3-ol
SMILES: CCC1COCc2nc3c(F)cc(cc3n12)-c1nc(N[C@@H]2CCN(C[C@H]2O)S(C)(=O)=O)ncc1F
SMILES: CCC1COCc2nc3c(F)cc(cc3n12)-c1nc(N[C@@H]2CCN(C[C@H]2O)S(C)(=O)=O)ncc1F
InChI key: SKASIVWDIMHKPE-FMRBYIFOSA-N
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