Name: VTP50469 mesylate
Rating: 5 (10 reviews)

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类似物检索

HIT ID:HIT220913759
Cas No:2169919-27-9
常用名:VTP50469 mesylate
IUPAC:5-fluoro-N,N-bis(propan-2-yl)-2-{[4-(7-{[(1r,4r)-4-methanesulfonamidocyclohexyl]methyl}-2,7-diazaspiro[3.5]nonan-2-yl)pyrimidin-5-yl]oxy}benzamide; bis(methanesulfonic acid)
IUPAC:5-fluoro-N,N-bis(propan-2-yl)-2-{[4-(7-{[(1r,4r)-4-methanesulfonamidocyclohexyl]methyl}-2,7-diazaspiro[3.5]nonan-2-yl)pyrimidin-5-yl]oxy}benzamide; bis(methanesulfonic acid)
InChI key:InChIKey=ZTQNQLWKNBDHRZ-SGBGZXBGSA-N

分子式:C34H55FN6O10S3
分子量:823.02
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CS(O)(=O)=O.CS(O)(=O)=O.CC(C)N(C(C)C)C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(C1)CCN(C[C@H]1CC[C@@H](CC1)NS(C)(=O)=O)CC2
SMILES:CS(O)(=O)=O.CS(O)(=O)=O.CC(C)N(C(C)C)C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(C1)CCN(C[C@H]1CC[C@@H](CC1)NS(C)(=O)=O)CC2

VTP-50469 is a novel, potent, selective, orally-available MeninMLL1 inhibitor, being effectively against MLL-rearranged and NPM1c+ leukemia, selectively killing cell lines with MLLrearrangements and NPM1c+ mutations.

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