(6aR,10aR)-3-[6-(imidazol-1-yl)-2-methylhexan-2-yl]-6,6,9-trimethyl-6aH,7H,10H,10aH-benzo[c]isochromen-1-ol hydrochloride, O-2545 hydrochloride
HIT218638251
sdf文件结构编辑类似物检索
HIT ID: HIT218638251
Cas No:
分子式: C26H37ClN2O2
分子量: 445.04
常用名: (6aR,10aR)-3-[6-(imidazol-1-yl)-2-methylhexan-2-yl]-6,6,9-trimethyl-6aH,7H,10H,10aH-benzo[c]isochromen-1-ol hydrochloride, O-2545 hydrochloride
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (6aR,10aR)-3-[6-(1H-imidazol-1-yl)-2-methylhexan-2-yl]-6,6,9-trimethyl-6H,6aH,7H,10H,10aH-benzo[c]isochromen-1-ol hydrochloride
SMILES: Cl.CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(cc1OC2(C)C)C(C)(C)CCCCn1ccnc1
InChI key: LSHUCXYFAOTXLT-MUCZFFFMSA-N
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