3-Bromo-1,2-propanediol → 4-(2,3-Dihydroxypropyl)-1-[4-[1-[3-(isopropylamino)-2-pyridyl]piperazin-4-yl-carbonyl]benzoyl]piperazine

HRID 182889

반응식

HRID 182889 반응식
[Br:33][CH2:34][CH:35]([CH2:36][OH:37])[OH:38].[CH:1]([CH3:2])([CH3:3])[NH:4][c:5]1[c:6]([N:11]2[CH2:12][CH2:13][N:14]([C:17](=[O:18])[c:19]3[cH:20][cH:21][c:22]([C:23](=[O:24])[N:25]4[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]4)[cH:31][cH:32]3)[CH2:15][CH2:16]2)[n:7][cH:8][cH:9][cH:10]1>>[CH:1]([CH3:2])([CH3:3])[NH:4][c:5]1[c:6]([N:11]2[CH2:12][CH2:13][N:14]([C:17](=[O:18])[c:19]3[cH:20][cH:21][c:22]([C:23](=[O:24])[N:25]4[CH2:26][CH2:27][N:28]([CH2:34][CH:35]([CH2:36][OH:37])[OH:38])[CH2:29][CH2:30]4)[cH:31][cH:32]3)[CH2:15][CH2:16]2)[n:7][cH:8][cH:9][cH:10]1

참가 물질

3

출처 및 근거

ORD 기록
ord-46740847a4fc4516ba67900291df11ec
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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