Water → 4-[2-(2-Fluorophenyl)-1,2,4-triazol-3-yl]aniline
반응식
[F:1][c:2]1[c:3](-[n:8]2[n:9][cH:10][n:11][c:12]2-[c:13]2[cH:14][cH:15][c:16]([N+:19]([O-:20])=[O:21])[cH:17][cH:18]2)[cH:4][cH:5][cH:6][cH:7]1.[O:22]1[CH2:23][CH2:24][O:25][CH2:26][CH2:27]1.[OH2:28]>>[F:1][c:2]1[c:3](-[n:8]2[n:9][cH:10][n:11][c:12]2-[c:13]2[cH:14][cH:15][c:16]([NH2:19])[cH:17][cH:18]2)[cH:4][cH:5][cH:6][cH:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-d0f6909544384f579d5273c005a62b0a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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