HCID 67411707, 화합물 → 2-Amino-2-[6-(4-tert-butylcyclohexyl)oxy-5-fluoronaphthalen-2-yl]propan-1-ol
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[C:38]([CH3:39])([CH3:40])([CH3:41])[CH:42]1[CH2:43][CH2:44][CH:45]([O:48][c:49]2[c:50]([F:66])[c:51]3[cH:52][cH:53][c:54]([C:59]4([CH3:65])[NH:60][C:61](=[O:64])[O:62][CH2:63]4)[cH:55][c:56]3[cH:57][cH:58]2)[CH2:46][CH2:47]1.[NH2:1][C:2]([c:3]1[cH:4][cH:5][c:6]2[c:7]([cH:8][cH:9][c:10]([O:11][CH:12]3[CH2:13][CH2:14][CH:15]([C:16]([CH3:17])([CH3:18])[CH3:19])[CH2:20][CH2:21]3)[c:22]2-[c:23]2[cH:24][cH:25][c:26]([O:27][C:28]([F:29])([F:30])[F:31])[cH:32][cH:33]2)[cH:34]1)([CH3:35])[CH2:36][OH:37]>>[C:38]([CH3:39])([CH3:40])([CH3:41])[CH:42]1[CH2:43][CH2:44][CH:45]([O:48][c:49]2[c:50]([F:66])[c:51]3[cH:52][cH:53][c:54]([C:59]([NH2:60])([CH2:63][OH:62])[CH3:65])[cH:55][c:56]3[cH:57][cH:58]2)[CH2:46][CH2:47]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-22cbd6b19adc4f96a86fd3331972126a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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