BIAdb Escholine chloride 2144

From DrugPedia: A Wikipedia for Drug discovery

Show 3-D Structure

Show 2-D Structure

BIAdb Escholine chloride 2144
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	23149
Chemical data
Formula	C20H24ClNO4
Mol. mass	377.86186
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

Contents 1 Description 2 Source 3 Function 4 General Properties 5 External Links

Description

Source

N/A

Function

Unknown

General Properties

*Molecular Weight

377.86186

*Exact Mass

377.139386

*Molecular Formula

C₂₀H₂₄ClNO₄

*IUPAC NAME

N/A

*Canonical Smiles

C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)O)OC)C.[Cl-]

*Isomeric Smiles

C[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)O)O)OC)C.[Cl-]

*XLogP

N/A

*Hydrogen bond donor

2

*Hydrogen bond acceptor

5

*Rotational Bond Count

2

*Topological Polar Surface Area

58.9

External Links

• Pubchem

Link to BIAdb Database