D030 SIGMA

From DrugPedia: A Wikipedia for Drug discovery

Revision as of 05:22, 23 April 2009 by Raghavagps (Talk | contribs)
(diff) ←Older revision | Current revision (diff) | Newer revision→ (diff)
Jump to: navigation, search

Show 3-D Structure

Show 2-D Structure

D030 SIGMA
Systematic (IUPAC) name
N/A
Identifiers
CAS number  ?
ATC code  ?
PubChem 10069059
Chemical data
Formula C19H22BrNO3
Mol. mass 392.28688
SMILES eMolecules & PubChem
Pharmacokinetic data
Bioavailability  ?
Metabolism  ?
Half life  ?
Excretion  ?
Therapeutic considerations
Pregnancy cat.

?

Legal status
Routes  ?

[edit] Description

[edit] General Properties

*Molecular Weight

392.28688

*Molecular Formula

C19H22BrNO3

*IUPAC NAME

N/A

*Canonical Smiles

CCCN1CCC2=C3C1CC4=C(C3=CC(=C2)O)C(=C(C=C4)O)O.Br

*Isomeric Smiles

CCCN1CCC2=C3[C@H]1CC4=C(C3=CC(=C2)O)C(=C(C=C4)O)O.Br

*XLogP

N/A

*Topological Polar Surface Area

63.9

[edit] External Links

Link to BIAdb Database