Sodium Ion → HCID 178480804, 화합물

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

참가 물질

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HCID 923Sodium Ion

HCID 961Hydroxide

HCID 866443141-[4-chloro-6-(4-methyl-1-piperazinyl)-1,3,5-triazin-2-yl]-N-{[2-(trifluoromethyl)phenyl]methyl}-4-piperidinecarboxamide

생성물 1

HCID 178480804HCID 178480804, 화합물

출처 및 근거

ORD 기록: ord-783673a4b56c4599bd08c7b7557eb826
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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