MLS000028867

From DrugPedia: A Wikipedia for Drug discovery

(Difference between revisions)
Jump to: navigation, search
(External Links)
Current revision (04:48, 11 December 2009) (edit) (undo)
(External Links)
 
Line 60: Line 60:
[http://crdd.osdd.net/raghava/biadb/detail.php?id=2061 Link to BIAdb Database]
[http://crdd.osdd.net/raghava/biadb/detail.php?id=2061 Link to BIAdb Database]
-
[[Category:BIAdb]]
+
[[Category:BIAdb_old]]

Current revision

Show 3-D Structure

Show 2-D Structure

MLS000028867
Systematic (IUPAC) name
N/A
Identifiers
CAS number  ?
ATC code  ?
PubChem 6852389
Chemical data
Formula C17H18ClNO2
Mol. mass 303.78332
SMILES eMolecules & PubChem
Pharmacokinetic data
Bioavailability  ?
Metabolism  ?
Half life  ?
Excretion  ?
Therapeutic considerations
Pregnancy cat.

?

Legal status
Routes  ?

[edit] Description

[edit] General Properties

*Molecular Weight

303.78332

*Molecular Formula

C17H18ClNO2

*IUPAC NAME

N/A

*Canonical Smiles

CN1CCC2=CC=CC3=C2C1CC4=C3C(=C(C=C4)O)O.Cl

*Isomeric Smiles

CN1CCC2=CC=CC3=C2[C@@H]1CC4=C3C(=C(C=C4)O)O.Cl

*XLogP

N/A

*Topological Polar Surface Area

43.7

[edit] External Links

Link to BIAdb Database