반응식
[C:30]([O:31][C:32]([N:33]1[CH2:34][CH2:35][CH:36]([NH2:37])[CH2:38]1)=[O:39])([CH3:40])([CH3:41])[CH3:42].[Cl:18][c:19]1[n:20][c:21]2[cH:22][c:23]([Cl:29])[cH:24][cH:25][c:26]2[cH:27][n:28]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]2[n:6][c:7]([NH:9][CH:10]3[CH2:11][NH:12][CH2:13][CH2:14]3)[o:8][c:15]2[cH:16]1.[ClH:17]>>[NH:9]([CH:10]1[CH2:11][NH:12][CH2:13][CH2:14]1)[c:19]1[n:20][c:21]2[cH:22][c:23]([Cl:29])[cH:24][cH:25][c:26]2[cH:27][n:28]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-348f9eeff23e4c188b80806dfd67e589
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…