Water → N-[3-[6-(1-phenylethylamino)pyrazin-2-yl]benzimidazol-5-yl]prop-2-enamide
반응식
[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[OH2:43].[OH:33][C:34](=[O:35])[CH:36]=[CH2:37].[c:1]1([CH:7]([CH3:8])[NH:9][c:10]2[cH:11][n:12][cH:13][c:14](-[n:16]3[cH:17][n:18][c:19]4[c:20]3[cH:21][c:22]([NH2:25])[cH:23][cH:24]4)[n:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([CH3:8])[NH:9][c:10]2[cH:11][n:12][cH:13][c:14](-[n:16]3[cH:17][n:18][c:19]4[c:20]3[cH:21][c:22]([NH:25][C:34](=[O:33])[CH:36]=[CH2:37])[cH:23][cH:24]4)[n:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-7a50b9e548394bb3916b19e47d798a66
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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