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[Cl:18][c:19]1[cH:20][cH:21][c:22](-[c:25]2[cH:26][cH:27][c:28]([C:31]#[CH:32])[n:29][cH:30]2)[cH:23][cH:24]1.[I:1][c:2]1[cH:3][c:4]2[cH:5][n:6][n:7]([CH2:11][CH2:12][N:13]3[CH2:14][CH2:15][CH2:16][CH2:17]3)[c:8]2[cH:9][cH:10]1>>[IH:1].[c:2]1([C:32]#[C:31][c:28]2[cH:27][cH:26][c:25](-[c:22]3[cH:21][cH:20][c:19]([Cl:18])[cH:24][cH:23]3)[cH:30][n:29]2)[cH:3][c:4]2[cH:5][n:6][n:7]([CH2:11][CH2:12][N:13]3[CH2:14][CH2:15][CH2:16][CH2:17]3)[c:8]2[cH:9][cH:10]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-bfbd2f25421f4a148161a789678b50fe
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…