JH-XII-03-02
HIT218851307
sdf文件结构编辑类似物检索
HIT ID: HIT218851307
Cas No: 2415900-86-4
分子式: C43H51N9O10
分子量: 853.934
常用名: JH-XII-03-02
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-(2,6-dioxopiperidin-3-yl)-4-[16-(4-{6-[5-(1-methylcyclopropoxy)-1H-indazol-3-yl]pyrimidin-4-yl}piperazin-1-yl)-16-oxo-4,7,10,13-tetraoxa-1-azahexadecan-1-yl]-2,3-dihydro-1H-isoindole-1,3-dione
IUPAC: 2-(2,6-dioxopiperidin-3-yl)-4-[16-(4-{6-[5-(1-methylcyclopropoxy)-1H-indazol-3-yl]pyrimidin-4-yl}piperazin-1-yl)-16-oxo-4,7,10,13-tetraoxa-1-azahexadecan-1-yl]-2,3-dihydro-1H-isoindole-1,3-dione
SMILES: CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCN(CC3)C(=O)CCOCCOCCOCCOCCNc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)c2c1
SMILES: CC1(CC1)Oc1ccc2[nH]nc(-c3cc(ncn3)N3CCN(CC3)C(=O)CCOCCOCCOCCOCCNc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)c2c1
InChI key: XYGRYBJBOSXMHE-UHFFFAOYSA-N
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