Details of the Drug

General Information of Drug (ID: DM06OLY)

Drug Name
Cyclohexylcarbamic acidbiphenyl-3-yl ester
Synonyms
CHEMBL431202; biphenyl-N-cyclopentyl-carbamate; 546141-07-5; URB524; URB-524; cyclohexylcarbamic acidbiphenyl-3-yl ester; SCHEMBL530169; 3-Biphenylyl cyclohexylcarbamate; biphenyl-3-yl-cyclohexylcarbamate; biphenyl-3-yl cyclohexylcarbamate; ZINC3816417; BDBM50128585; AKOS015909861; KB-48012; Cyclohexyl-carbamic acid biphenyl-3-yl ester
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 295.4
Logarithm of the Partition Coefficient (xlogp) 4.9
Rotatable Bond Count (rotbonds) 4
Hydrogen Bond Donor Count (hbonddonor) 1
Hydrogen Bond Acceptor Count (hbondacc) 2
Chemical Identifiers
Formula
C19H21NO2
IUPAC Name
(3-phenylphenyl) N-cyclohexylcarbamate
Canonical SMILES
C1CCC(CC1)NC(=O)OC2=CC=CC(=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H21NO2/c21-19(20-17-11-5-2-6-12-17)22-18-13-7-10-16(14-18)15-8-3-1-4-9-15/h1,3-4,7-10,13-14,17H,2,5-6,11-12H2,(H,20,21)
InChIKey
KGKDDSYRBQOMLE-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
10108554
TTD ID
D01HBS

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Fatty acid amide hydrolase (FAAH) TTDP1UC NOUNIPROTAC Inhibitor [1]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

Molecular Expression Atlas of This Drug

The Studied Disease Discovery agent
ICD Disease Classification N.A.
Molecule Name Molecule Type Gene Name p-value Fold-Change Z-score
Fatty acid amide hydrolase (FAAH) DTT NO-GeName 2.65E-01 0.02 0.1
Molecular Expression Atlas (MEA) Jump to Detail Molecular Expression Atlas of This Drug

References

1 Synthesis and quantitative structure-activity relationship of fatty acid amide hydrolase inhibitors: modulation at the N-portion of biphenyl-3-yl a... J Med Chem. 2008 Jun 26;51(12):3487-98.