BIAdb 3'-hydroxypapaverine 1046

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BIAdb 3'-hydroxypapaverine 1046
Systematic (IUPAC) name
5-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-2-methoxyphenol
Identifiers
CAS number	?
ATC code	?
PubChem	167736
Chemical data
Formula	C₁₉H₁₉NO₄
Mol. mass	325.35846
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

N/A

Unknown

*Molecular Weight

325.35846

*Exact Mass

325.131408

*Molecular Formula

C₁₉H₁₉NO₄

*IUPAC NAME

5-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-2-methoxyphenol

*Canonical Smiles

COC1=C(C=C(C=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