Details of the Drug

General Information of Drug (ID: DMR2FPO)

Drug Name

FK-584

Synonyms

4,4-Diphenylcyclopentenylamine hydrochloride; 2-Cyclopenten-1-amine, 4,4-diphenyl-, hydrochloride; 4,4-diphenyl-2-cyclopentenylamine; FK 584; 56740-43-3; AC1L57OZ; LS-58284; 4,4-diphenylcyclopent-2-en-1-amine hydrochloride

Indication

Disease Entry	ICD 11	Status	REF
Central and peripheral nervous disease	8A04-8E7Z	Discontinued in Phase 2	[1]

Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski): 0

Molecular Weight (mw)

291.4

Logarithm of the Partition Coefficient (xlogp)

5

Rotatable Bond Count (rotbonds)

4

Hydrogen Bond Donor Count (hbonddonor)

1

Hydrogen Bond Acceptor Count (hbondacc)

1

Chemical Identifiers

Formula: C21H25N
IUPAC Name: (1S)-N-tert-butyl-4,4-diphenylcyclopent-2-en-1-amine
Canonical SMILES: CC(C)(C)N[C@H]1CC(C=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI: InChI=1S/C21H25N/c1-20(2,3)22-19-14-15-21(16-19,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-15,19,22H,16H2,1-3H3/t19-/m1/s1
InChIKey: QMTVTICJRCJOFZ-LJQANCHMSA-N

Cross-matching ID

PubChem CID: 9947991
TTD ID: D0IJ2H

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Muscarinic acetylcholine receptor M5 (CHRM5)	TTH18TF	ACM5_HUMAN	Modulator	[2]

Molecular Interaction Atlas (MIA)

MIA Detail

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800006686)
2	US patent application no. 2005,0261,328, Pharmaceutical composition comprising beta-3-adrenoceptor-agonists and antimuscarinic agents.