HIT ID: HIT212667205
Cas No: 1246018-36-9
分子式: C12H14N8O
分子量: 286.299
常用名: ST4206
氢键受体数 (HBA): 7
氢键供体数 (HBD): 1
LogP: 1.033
IUPAC: 4-[6-amino-9-methyl-8-(2H-1,2,3-triazol-2-yl)-9H-purin-2-yl]butan-2-one
IUPAC: 4-[6-amino-9-methyl-8-(2H-1,2,3-triazol-2-yl)-9H-purin-2-yl]butan-2-one
SMILES: CC(=O)CCc1nc(N)c2nc(-n3nccn3)n(C)c2n1
SMILES: CC(=O)CCc1nc(N)c2nc(-n3nccn3)n(C)c2n1
InChI key: PLXYHOBIHWLDSZ-UHFFFAOYSA-N