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Ligand

NameCHEMBL182146
Molecular formulaC28H25F6N3O3
IUPAC name5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-9-morpholin-4-yl-7-phenyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one
Molecular weight565.516
Hydrogen bond acceptor11
Hydrogen bond donor0
XlogP5.7
SynonymsN/A
Inchi KeyCTAAVMUWEAKCGO-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H25F6N3O3/c29-27(30,31)20-13-18(14-21(15-20)28(32,33)34)17-37-7-4-10-40-25-24(26(37)38)22(19-5-2-1-3-6-19)16-23(35-25)36-8-11-39-12-9-36/h1-3,5-6,13-16H,4,7-12,17H2
PubChem CID44389653
ChEMBLCHEMBL182146
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
49927Substance-P receptorP30547TACR1Cavia porcellus (Guinea pig)407

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