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Ligand

NameCHEMBL3672989
Molecular formulaC19H17ClF2N4O3
IUPAC name1-[2-chloro-4-[(2R)-morpholin-2-yl]phenyl]-3-[5-cyano-2-(difluoromethoxy)phenyl]urea
Molecular weight422.817
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP2.8
SynonymsBDBM158253
SCHEMBL14151202
US9029370, 47
Inchi KeyBZPDPMRSUULMIB-KRWDZBQOSA-N
Inchi IDInChI=1S/C19H17ClF2N4O3/c20-13-8-12(17-10-24-5-6-28-17)2-3-14(13)25-19(27)26-15-7-11(9-23)1-4-16(15)29-18(21)22/h1-4,7-8,17-18,24H,5-6,10H2,(H2,25,26,27)/t17-/m0/s1
PubChem CID71087095
ChEMBLCHEMBL3672989
IUPHARN/A
BindingDB158253
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
467435Trace amine-associated receptor 1Q923Y9Taar1Rattus norvegicus (Rat)332
467436Trace amine-associated receptor 1Q923Y8Taar1Mus musculus (Mouse)332

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