Predicentrine
From DrugPedia: A Wikipedia for Drug discovery
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[http://crdd.osdd.net/raghava/biadb/detail.php?id=2028 Link to BIAdb Database] | [http://crdd.osdd.net/raghava/biadb/detail.php?id=2028 Link to BIAdb Database] | ||
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Revision as of 11:49, 10 December 2009
Predicentrine
| |
Systematic (IUPAC) name | |
N/A | |
Identifiers | |
CAS number | ? |
ATC code | ? |
PubChem | |
Chemical data | |
Formula | C20H23NO4 |
Mol. mass | 341.40092 |
SMILES | & |
Pharmacokinetic data | |
Bioavailability | ? |
Metabolism | ? |
Half life | ? |
Excretion | ? |
Therapeutic considerations | |
Pregnancy cat. |
? |
Legal status | |
Routes | ? |
Description
General Properties
*Molecular Weight
341.40092
*Molecular Formula
C20H23NO4
*IUPAC NAME
N/A
*Canonical Smiles
CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)OC)OC)O
*Isomeric Smiles
N/A
*XLogP
2.6
*Topological Polar Surface Area
51.2