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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Cholinesterase | ||
| Ligand | BDBM50496394 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1297410 (CHEMBL3129628) | ||
| IC50 | 64320±n/a nM | ||
| Citation |  Thiratmatrakul, S; Yenjai, C; Waiwut, P; Vajragupta, O; Reubroycharoen, P; Tohda, M; Boonyarat, C Synthesis, biological evaluation and molecular modeling study of novel tacrine-carbazole hybrids as potential multifunctional agents for the treatment of Alzheimer's disease. Eur J Med Chem75:21-30 (2014) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Cholinesterase | |||
| Name: | Cholinesterase | ||
| Synonyms: | Acylcholine acylhydrolase | BCHE | Butyrylcholine esterase (BChE) | Butyrylcholinesterase (BChE) | Butyrylcholinesterase (BuChE) | CHE1 | CHLE_HUMAN | Choline esterase II | Cholinesterases | Cholinesterases; ACHE & BCHE | Pseudocholinesterase | ||
| Type: | Homotetramer | ||
| Mol. Mass.: | 68422.27 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P06276 | ||
| Residue: | 602 | ||
| Sequence: |
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| BDBM50496394 | |||
| n/a | |||
| Name | BDBM50496394 | ||
| Synonyms: | CHEMBL3127383 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C35H38N4O2 | ||
| Mol. Mass. | 546.7018 | ||
| SMILES | COc1ccc2c(c1)[nH]c1c(CC=C(C)C)c(O)c(\C=N\CCCNc3c4CCCCc4nc4ccccc34)cc21 |(24.86,-9.57,;24.24,-10.98,;22.71,-11.14,;21.8,-9.89,;20.27,-10.05,;19.64,-11.46,;20.55,-12.7,;22.08,-12.54,;19.64,-13.95,;18.18,-13.48,;16.84,-14.25,;16.84,-15.79,;15.51,-16.56,;15.51,-18.09,;14.18,-18.87,;16.84,-18.87,;15.51,-13.48,;14.18,-14.25,;15.51,-11.93,;14.18,-11.17,;14.18,-9.63,;12.84,-8.86,;11.51,-9.63,;10.18,-8.86,;8.84,-9.63,;7.51,-8.86,;7.51,-7.32,;8.84,-6.54,;8.84,-5,;7.51,-4.23,;6.17,-5,;6.17,-6.54,;4.84,-7.32,;4.84,-8.86,;3.51,-9.63,;3.51,-11.17,;4.84,-11.93,;6.17,-11.17,;6.17,-9.63,;16.84,-11.17,;18.18,-11.93,)| | ||
| Structure | 
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