Ammonia → 3-((Imino((2,2,2-trifluoroethyl)amino)methyl)amino)1H-pyrazole-1-pentamide
반응식
[CH2:23]([OH:24])[CH3:25].[F:1][C:2]([CH2:3][NH:4][C:5]([NH:6][c:7]1[n:8][n:9]([CH2:12][CH2:13][CH2:14][CH2:15][C:16](=[O:17])[NH2:18])[cH:10][cH:11]1)=[S:19])([F:20])[F:21].[NH3:22]>>[F:1][C:2]([CH2:3][N:4]=[C:5]([NH:6][c:7]1[n:8][n:9]([CH2:12][CH2:13][CH2:14][CH2:15][C:16](=[O:17])[NH2:18])[cH:10][cH:11]1)[NH2:22])([F:20])[F:21]참가 물질
4
출처 및 근거
- ORD 기록
- ord-4e425a70f09347a294c796fc1eaf4ed1
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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