반응식
[Cl:1][c:2]1[n:3][cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][c:12]3[c:13]([nH:16][c:17](-[c:19]4[n:20][nH:21][c:22]5[cH:23][c:24](-[c:28]6[c:29]([CH2:36][CH3:37])[cH:30][c:31]([OH:35])[c:32]([F:34])[cH:33]6)[cH:25][cH:26][c:27]45)[n:18]3)[CH2:14][CH2:15]2)[n:6][cH:7]1.[N:38]1([CH2:43][CH2:44][NH2:45])[CH2:39][CH2:40][CH2:41][CH2:42]1>>[c:2]1([NH:45][CH2:44][CH2:43][N:38]2[CH2:39][CH2:40][CH2:41][CH2:42]2)[n:3][cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][c:12]3[c:13]([nH:16][c:17](-[c:19]4[n:20][nH:21][c:22]5[cH:23][c:24](-[c:28]6[c:29]([CH2:36][CH3:37])[cH:30][c:31]([OH:35])[c:32]([F:34])[cH:33]6)[cH:25][cH:26][c:27]45)[n:18]3)[CH2:14][CH2:15]2)[n:6][cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-80ac82e029d74870932f3d8c73159af2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…