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[CH3:27][O:28][c:29]1[cH:30][c:31]([NH2:35])[cH:32][cH:33][c:34]1[NH2:36].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]3[n:11][cH:12][n:13](-[c:18]4[cH:19][c:20]([O:25][CH3:26])[c:21]([OH:24])[cH:22][cH:23]4)[c:14](=[O:17])[c:15]3[s:16]2)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]3[n:11][cH:12][n:13](-[c:18]4[cH:19][c:20]([O:25][CH3:26])[c:21]([NH2:35])[cH:22][cH:23]4)[c:14](=[O:17])[c:15]3[s:16]2)[cH:6][cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-5c78fc05aecd41099352adda63cd841f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…