Amuvatinib
HIT211999746
sdf文件结构编辑类似物检索
HIT ID: HIT211999746
Cas No: 850879-09-3
分子式: C23H21N5O3S
分子量: 447.51
常用名: Amuvatinib
氢键受体数 (HBA): 5
氢键供体数 (HBD): 1
LogP: 3.5178092
IUPAC: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaen-6-yl}piperazine-1-carbothioamide
IUPAC: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaen-6-yl}piperazine-1-carbothioamide
SMILES: S=C(NCc1ccc2OCOc2c1)N1CCN(CC1)c1ncnc2c3ccccc3oc12
SMILES: S=C(NCc1ccc2OCOc2c1)N1CCN(CC1)c1ncnc2c3ccccc3oc12
InChI key: FOFDIMHVKGYHRU-UHFFFAOYSA-N
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