N-(5-bromothiazolo[5,4-b]pyridin-2-yl)-4-(1-hydroxy-2-methylpropan-2-yl)benzamide → HCID 178450177, 화합물
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[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7]1)[s:8][c:9]([NH:11][C:12]([c:13]1[cH:14][cH:15][c:16]([C:19]([CH2:20][OH:21])([CH3:22])[CH3:23])[cH:17][cH:18]1)=[O:24])[n:10]2.[CH3:25][C:26]1([CH3:27])[C:28]([CH3:29])([CH3:30])[O:31][B:32]([c:33]2[cH:34][cH:35][c:36]([OH:39])[n:37][cH:38]2)[O:40]1>>[c:2]1(-[c:33]2[cH:34][cH:35][c:36]([OH:39])[n:37][cH:38]2)[cH:3][cH:4][c:5]2[c:6]([n:7]1)[s:8][c:9]([NH:11][C:12]([c:13]1[cH:14][cH:15][c:16]([C:19]([CH2:20][OH:21])([CH3:22])[CH3:23])[cH:17][cH:18]1)=[O:24])[n:10]2참가 물질
3
출처 및 근거
- ORD 기록
- ord-11a8ac2a97a6495885ec5cb384c2065a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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