Dichloromethane → 3-[3-[[2-(3-Chloro-4-methylsulfonylphenyl)-3-cyclopentylpropanoyl]amino]pyrazol-1-yl]propanoic acid
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH2:8][n:9]1[n:10][c:11]([NH:14][C:15]([CH:16]([CH2:17][CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22]2)[c:23]2[cH:24][c:25]([Cl:33])[c:26]([S:29](=[O:30])(=[O:31])[CH3:32])[cH:27][cH:28]2)=[O:34])[cH:12][cH:13]1)=[O:35].[CH2:36]([Cl:37])[Cl:38].[F:39][C:40]([F:41])([F:42])[C:43]([OH:44])=[O:45]>>[O:5]=[C:6]([CH2:7][CH2:8][n:9]1[n:10][c:11]([NH:14][C:15]([CH:16]([CH2:17][CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22]2)[c:23]2[cH:24][c:25]([Cl:33])[c:26]([S:29](=[O:30])(=[O:31])[CH3:32])[cH:27][cH:28]2)=[O:34])[cH:12][cH:13]1)[OH:35]참가 물질
4
출처 및 근거
- ORD 기록
- ord-376803cabe41440fb33638432bece6f5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
반응 노트
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