BIAdb 4'-hydroxypapaverine 1053
From DrugPedia: A Wikipedia for Drug discovery
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[http://crdd.osdd.net/raghava/biadb/detail.php?id=1053 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=1053 Link to BIAdb Database] | ||
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Current revision
| BIAdb 4'-hydroxypapaverine 1053
| |
| Systematic (IUPAC) name | |
| 4-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-2-methoxyphenol | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C19H19NO4 |
| Mol. mass | 325.35846 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
N/A
[edit] Function
Unknown
[edit] General Properties
*Molecular Weight
325.35846
*Exact Mass
325.131408
*Molecular Formula
C19H19NO4
*IUPAC NAME
4-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-2-methoxyphenol
*Canonical Smiles
COC1=C(C=CC(=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)O
*Isomeric Smiles
N/A
*XLogP
3.6
*Hydrogen bond donor
1
*Hydrogen bond acceptor
5
*Rotational Bond Count
5
*Topological Polar Surface Area
60.8
