CHLORCYCLIZINE

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: R06AE04
UNII: M26C4IP44P

Structure
InChI Key WFNAKBGANONZEQ-UHFFFAOYSA-N
Smile CN1CCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1
InChI
InChI=1S/C18H21ClN2/c1-20-11-13-21(14-12-20)18(15-5-3-2-4-6-15)16-7-9-17(19)10-8-16/h2-10,18H,11-14H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H21ClN2
Molecular Weight 300.83
AlogP 3.68
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 3.0
Polar Surface Area 6.48
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 21.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Ion channel Other ion channel Miscellaneous ion channel Bcl-2 family
- - 60000 - -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Histamine receptor
- - - - 16

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 94402
ChEMBL CHEMBL22150
DrugBank DB08936
DrugCentral 593
EPA CompTox DTXSID9048011
FDA SRS M26C4IP44P
Human Metabolome Database HMDB0240224
PubChem 2710
SureChEMBL SCHEMBL4383
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