Tyramine → 4-{2-[4-(4-Ethoxy-phenyl)-pyrimidin-2-ylamino]-ethyl}-phenol
반응식
[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7](-[c:10]2[n:11][c:12]([Cl:16])[n:13][cH:14][cH:15]2)[cH:8][cH:9]1.[NH2:17][CH2:18][CH2:19][c:20]1[cH:21][cH:22][c:23]([OH:24])[cH:25][cH:26]1>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7](-[c:10]2[n:11][c:12]([NH:17][CH2:18][CH2:19][c:20]3[cH:21][cH:22][c:23]([OH:24])[cH:25][cH:26]3)[n:13][cH:14][cH:15]2)[cH:8][cH:9]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-a1a61f73c4984257a1f49b633217b846
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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