Water → HCID 178512983, 화합물
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[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:28][S:29][C:30]([NH2:31])=[NH:32].[CH:33]([N:34]([CH2:35][CH3:36])[CH:37]([CH3:38])[CH3:39])([CH3:40])[CH3:41].[Cl:48][CH2:49][Cl:50].[F:1][c:2]1[cH:3][c:4]2[c:5]3[cH:6][c:7]4[c:8]([c:9]([O:15][CH2:16][CH2:17][CH2:18][NH2:19])[c:10]3[nH:11][c:12]2[cH:13][cH:14]1)[nH:20][c:21]1[cH:22][cH:23][c:24]([F:27])[cH:25][c:26]41.[OH2:47]>>[F:1][c:2]1[cH:3][c:4]2[c:5]3[cH:6][c:7]4[c:8]([c:9]([O:15][CH2:16][CH2:17][CH2:18][NH:19][C:30](=[NH:31])[NH2:32])[c:10]3[nH:11][c:12]2[cH:13][cH:14]1)[nH:20][c:21]1[cH:22][cH:23][c:24]([F:27])[cH:25][c:26]41참가 물질
7
출처 및 근거
- ORD 기록
- ord-c4f55ca2c51e423d9c94abf3662aa30f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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