PROTAC erf3a Degrader-2
HIT218887350
sdf文件结构编辑类似物检索
HIT ID: HIT218887350
Cas No: 3033871-15-4
分子式: C44H52N6O6
分子量: 760.936
常用名: PROTAC erf3a Degrader-2
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (4aR,4bS,6aS,7S,9aS,9bS,11aR)-N-(3-{[(1R,3R)-3-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}cyclohexyl]amino}phenyl)-4a,6a-dimethyl-2-oxo-1H,2H,4aH,4bH,5H,6H,6aH,7H,8H,9H,9aH,9bH,10H,11H,11aH-indeno[5,4-f]quinoline-7-carboxamide
IUPAC: (4aR,4bS,6aS,7S,9aS,9bS,11aR)-N-(3-{[(1R,3R)-3-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}cyclohexyl]amino}phenyl)-4a,6a-dimethyl-2-oxo-1H,2H,4aH,4bH,5H,6H,6aH,7H,8H,9H,9aH,9bH,10H,11H,11aH-indeno[5,4-f]quinoline-7-carboxamide
SMILES: [H][C@@]12CC[C@H](C(=O)Nc3cccc(N[C@@H]4CCC[C@H](C4)Nc4cccc5C(=O)N(C6CCC(=O)NC6=O)C(=O)c45)c3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])NC(=O)C=C[C@]12C
SMILES: [H][C@@]12CC[C@H](C(=O)Nc3cccc(N[C@@H]4CCC[C@H](C4)Nc4cccc5C(=O)N(C6CCC(=O)NC6=O)C(=O)c45)c3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])NC(=O)C=C[C@]12C
InChI key: BWWZXNOTASSCDI-NUCPEGCXSA-N
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