Cocaine
(PIQVDUKEQYOJNR-VZXSFKIWSA-N)
Structure
- SMILES
- COC(=O)[C@H]1[C@H](C[C@H]2N([C@@H]1CC2)C)OC(=O)c1ccccc1.Cl
- Molecular Formula:
- C17H22ClNO4
- Molecular Weight:
- 339.814
- Log P:
- 2.6076
- Hydrogen Bond Acceptor:
- 5
- Hydrogen Bond Donor:
- 1
- TPSA:
- 55.84
- CAS Number(s):
- 53-21-4
Synonym(s)
1.
Cocaine
2.
Cocaine HCl
3.
Cocaine Hydrochloride
4.
HCl, Cocaine
5.
Hydrochloride, Cocaine
External Link(s)
| MeSH | D003042 |
| PubChem Compound | 11302220 656832 |
| ChEBI | 613010 |
| CHEMBL | CHEMBL529437 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Drug ineffective | FAERS: 1 | US FAERS |
Powered by :
Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120295
Copyright © 2019-2020 Laboratory of Molecular Modeling and Design, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology. All rights reserved.