BIAdb LS-97010 2565
From DrugPedia: A Wikipedia for Drug discovery
BIAdb LS-97010 2565
| |
Systematic (IUPAC) name | |
N/A | |
Identifiers | |
CAS number | ? |
ATC code | ? |
PubChem | |
Chemical data | |
Formula | C23H22ClNO2 |
Mol. mass | 379.87928 |
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
379.87928
*Exact Mass
379.133907
*Molecular Formula
C23H22ClNO2
*IUPAC NAME
N/A
*Canonical Smiles
C1C[NH+](C2CC3=C(C4=C2C1=CC=C4)C(=C(C=C3)O)O)CC5=CC=CC=C5.[Cl-]
*Isomeric Smiles
C1C[NH+]([C@@H]2CC3=C(C4=C2C1=CC=C4)C(=C(C=C3)O)O)CC5=CC=CC=C5.[Cl-]
*XLogP
N/A
*Hydrogen bond donor
3
*Hydrogen bond acceptor
3
*Rotational Bond Count
2
*Topological Polar Surface Area
44.9