1-Amino-2-propanol → N-(2-hydroxypropyl)-3-[4-(trifluoromethyl)phenyl]azetidine-1-carboxamide
반응식
[C:33]([c:34]1[cH:35][cH:36][c:37]([CH:38]2[CH2:39][N:40]([C:41]([NH:42][CH2:43][CH:44]=[CH2:45])=[O:48])[CH2:46]2)[cH:47][cH:49]1)([CH3:50])([CH3:51])[CH3:52].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]2[CH2:10][N:11]([CH:13]([c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:12]2)[cH:7][cH:8]1)([F:26])[F:27].[NH2:28][CH2:29][CH:30]([CH3:31])[OH:32].[OH2:53]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]2[CH2:10][N:11]([C:13]([NH:28][CH2:29][CH:30]([CH3:31])[OH:32])=[O:48])[CH2:12]2)[cH:7][cH:8]1)([F:26])[F:27]참가 물질
5
출처 및 근거
- ORD 기록
- ord-ae7b18b1899a4019a35db2bd8eca7514
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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