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[CH3:17][O:18][CH2:19][CH2:20][Cl:21].[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([C:15]#[N:16])[c:8]([C:11]([F:12])([F:13])[F:14])[c:9]2[cH:10]1>>[CH3:1][c:2]1[n:3]([CH2:20][CH2:19][O:18][CH3:17])[c:4]2[cH:5][cH:6][c:7]([C:15]#[N:16])[c:8]([C:11]([F:12])([F:13])[F:14])[c:9]2[cH:10]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-31e67d2f7f8d46c0abaa100dd458e7a7
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…