Water → HCID 58447041, 화합물
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[Br:1][c:2]1[n:3][c:4]([Cl:11])[c:5]2[n:6]([cH:7]1)[cH:8][n:9][n:10]2.[CH2:25]1[O:26][CH2:27][CH2:28][CH2:29]1.[N:12]1([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:13][CH2:14][NH:15][CH2:16][CH2:17]1.[OH2:30]>>[Br:1][c:2]1[n:3][c:4]([N:15]2[CH2:14][CH2:13][N:12]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:17][CH2:16]2)[c:5]2[n:6]([cH:7]1)[cH:8][n:9][n:10]2참가 물질
5
출처 및 근거
- ORD 기록
- ord-edb23bd7ecba4df68cdbbd0c38333873
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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