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[Br:11][CH2:12][c:13]1[cH:14][c:15]([F:19])[cH:16][cH:17][cH:18]1.[CH2:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[NH:27][C:28](=[O:29])[c:30]1[c:31]([CH3:41])[n:32][c:33]([N:35]2[C:36](=[O:40])[NH:37][CH2:38][CH2:39]2)[s:34]1.[Cl:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([C:7]#[N:8])[cH:9][cH:10]1>>[CH2:12]([c:13]1[cH:14][c:15]([F:19])[cH:16][cH:17][cH:18]1)[N:37]1[C:36](=[O:40])[N:35]([c:33]2[n:32][c:31]([CH3:41])[c:30]([C:28]([NH:27][CH2:20][c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)=[O:29])[s:34]2)[CH2:39][CH2:38]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-a54973034b534d32b59a00cabfb5b87d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…