ECOPIPAM HYDROCHLORIDE

Search structure
Synonyms:
Status: Phase 2
Entry Type: Unknown
Molecule Category: Salt
Parent Compound: ECOPIPAM

Structure
InChI Key APFMVAHRFWBCDG-JUOYHRLASA-N
Smile CN1CCc2cc(Cl)c(O)cc2[C@H]2c3ccccc3CC[C@@H]21.Cl
InChI
InChI=1S/C19H20ClNO.ClH/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21;/h2-5,10-11,17,19,22H,6-9H2,1H3;1H/t17-,19+;/m0./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H21Cl2NO
Molecular Weight 350.29
AlogP 3.98
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 0.0
Polar Surface Area 23.47
Molecular species None
Aromatic Rings 2.0
Heavy Atoms 22.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Dopamine receptor
- 1.5 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Tourette Syndrome 3 D005879 ClinicalTrials

Related Entries

Scaffolds

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