Mitoxantrone
HIT103153197
sdf文件结构编辑类似物检索
HIT ID: HIT103153197
Cas No: 65271-80-9
分子式: C22H28N4O6
分子量: 444.488
常用名: Mitoxantrone
氢键受体数 (HBA): 6
氢键供体数 (HBD): 8
LogP: 0.451
IUPAC: 1,4-dihydroxy-5,8-bis({2-[(2-hydroxyethyl)amino]ethyl}amino)-9,10-dihydroanthracene-9,10-dione
IUPAC: 1,4-dihydroxy-5,8-bis({2-[(2-hydroxyethyl)amino]ethyl}amino)-9,10-dihydroanthracene-9,10-dione
SMILES: OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12
SMILES: OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12
InChI key: KKZJGLLVHKMTCM-UHFFFAOYSA-N
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