Name: KTX-612
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT220912366
Cas No:2573298-14-1
常用名:KTX-612
IUPAC:N-[6-(2-hydroxypropan-2-yl)-2-[(1r,4r)-4-{[2-({[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}methyl)-7-azaspiro[3.5]nonan-7-yl]methyl}cyclohexyl]-2H-indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
IUPAC:N-[6-(2-hydroxypropan-2-yl)-2-[(1r,4r)-4-{[2-({[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}methyl)-7-azaspiro[3.5]nonan-7-yl]methyl}cyclohexyl]-2H-indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
InChI key:InChIKey=IWOVTMLUFGDAGD-OBYWWQMUSA-N

分子式:C46H51F3N8O6
分子量:868.959
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(C)(O)c1cc2nn(cc2cc1NC(=O)c1cccc(n1)C(F)(F)F)[C@H]1CC[C@H](CN2CCC3(CC(CNc4cccc5C(=O)N(C6CCC(=O)NC6=O)C(=O)c45)C3)CC2)CC1
SMILES:CC(C)(O)c1cc2nn(cc2cc1NC(=O)c1cccc(n1)C(F)(F)F)[C@H]1CC[C@H](CN2CCC3(CC(CNc4cccc5C(=O)N(C6CCC(=O)NC6=O)C(=O)c45)C3)CC2)CC1

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