반응식
[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[Cl:1][c:2]1[n:3][c:4]([Cl:16])[c:5]2[n:6][cH:7][n:8]([CH:11]3[CH2:12][CH2:13][CH2:14][CH2:15]3)[c:9]2[n:10]1.[c:17]1([NH:23][CH2:24][CH2:25][NH2:26])[cH:18][cH:19][cH:20][cH:21][cH:22]1>>[Cl:1][c:2]1[n:3][c:4]([NH:26][CH2:25][CH2:24][NH:23][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:5]2[n:6][cH:7][n:8]([CH:11]3[CH2:12][CH2:13][CH2:14][CH2:15]3)[c:9]2[n:10]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-d193161d6232419ba74a6e652a661e2d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…