BIAdb Columbamine,iodide 1931
From DrugPedia: A Wikipedia for Drug discovery
| BIAdb Columbamine,iodide 1931
| |
| Systematic (IUPAC) name | |
| 3,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2-oliodide | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C20H20INO4 |
| Mol. mass | 465.28157 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
N/A
[edit] Function
Anti-HIV
[edit] General Properties
*Molecular Weight
465.28157
*Exact Mass
465.043701
*Molecular Formula
C20H20INO4
*IUPAC NAME
3,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2-oliodide
*Canonical Smiles
COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)O)OC.[I-]
*Isomeric Smiles
N/A
*XLogP
N/A
*Hydrogen bond donor
1
*Hydrogen bond acceptor
5
*Rotational Bond Count
3
*Topological Polar Surface Area
51.8
