반응식
[CH3:25][NH:26][CH3:27].[ClH:24].[F:1][c:2]1[cH:3][c:4](-[n:8]2[c:9]([CH3:23])[n:10][c:11]([C:13]#[C:14][c:15]3[cH:16][c:17]([C:18]#[N:19])[cH:20][cH:21][cH:22]3)[cH:12]2)[cH:5][n:6][cH:7]1>>[c:2]1([N:26]([CH3:25])[CH3:27])[cH:3][c:4](-[n:8]2[c:9]([CH3:23])[n:10][c:11]([C:13]#[C:14][c:15]3[cH:16][c:17]([C:18]#[N:19])[cH:20][cH:21][cH:22]3)[cH:12]2)[cH:5][n:6][cH:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-b5553770a3094499813aa86cca5ef4f5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…