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[CH3:42][C:43]#[N:44].[CH:33]([N:34]([CH2:35][CH3:36])[CH:37]([CH3:38])[CH3:39])([CH3:40])[CH3:41].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][NH:10][c:11]2[c:12]3[c:13]([n:14][cH:15][n:16]2)[CH2:17][CH2:18][NH:19][CH2:20]3)[cH:7][n:8]1)([F:21])[F:22].[F:23][c:24]1[c:25]([C:26]#[N:27])[cH:28][c:29]([F:32])[cH:30][cH:31]1>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH2:9][NH:10][c:11]2[c:12]3[c:13]([n:14][cH:15][n:16]2)[CH2:17][CH2:18][N:19]([c:24]2[c:25]([C:26]#[N:27])[cH:28][c:29]([F:32])[cH:30][cH:31]2)[CH2:20]3)[cH:7][n:8]1)([F:21])[F:22]참가 물질
5
출처 및 근거
- ORD 기록
- ord-ac2f391d6b36433d9fb4737910b37d5f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…