Name: JH-XII-03-02
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT218851307
Cas No:2415900-86-4
常用名:JH-XII-03-02
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
InChI key:XYGRYBJBOSXMHE-UHFFFAOYSA-N

分子式:C43H51N9O10
分子量:853.934
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
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

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