1-Fluoro-2-iodobenzene → N-[3-(1-{[1-(2-Fluorophenyl)-1H-indol-4-YL]methyl}-4-piperidinyl)phenyl]-2-methylpropanamide
반응식
[F:1][c:2]1[c:3]([I:8])[cH:4][cH:5][cH:6][cH:7]1.[nH:9]1[cH:10][cH:11][c:12]2[c:13]([CH2:18][N:19]3[CH2:20][CH2:21][CH:22]([c:25]4[cH:26][c:27]([NH:31][C:32]([CH:33]([CH3:34])[CH3:35])=[O:36])[cH:28][cH:29][cH:30]4)[CH2:23][CH2:24]3)[cH:14][cH:15][cH:16][c:17]12>>[F:1][c:2]1[c:3](-[n:9]2[cH:10][cH:11][c:12]3[c:13]([CH2:18][N:19]4[CH2:20][CH2:21][CH:22]([c:25]5[cH:26][c:27]([NH:31][C:32]([CH:33]([CH3:34])[CH3:35])=[O:36])[cH:28][cH:29][cH:30]5)[CH2:23][CH2:24]4)[cH:14][cH:15][cH:16][c:17]23)[cH:4][cH:5][cH:6][cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-381b16abfe004b3f936a0ba2ea2a7075
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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