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Ligand

NameCHEMBL3318840
Molecular formulaC58H72Cl2F2N2O6
IUPAC namebis[4-(4-chlorophenyl)-1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl] hexadecanedioate
Molecular weight1002.12
Hydrogen bond acceptor10
Hydrogen bond donor0
XlogP14.6
SynonymsBDBM50053385
Inchi KeyAPANCCIVVADHPY-UHFFFAOYSA-N
Inchi IDInChI=1S/C58H72Cl2F2N2O6/c59-49-27-23-47(24-28-49)57(35-41-63(42-36-57)39-13-15-53(65)45-19-31-51(61)32-20-45)69-55(67)17-11-9-7-5-3-1-2-4-6-8-10-12-18-56(68)70-58(48-25-29-50(60)30-26-48)37-43-64(44-38-58)40-14-16-54(66)46-21-33-52(62)34-22-46/h19-34H,1-18,35-44H2
PubChem CID118709168
ChEMBLCHEMBL3318840
IUPHARN/A
BindingDB50053385
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis 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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
442128D(1A) dopamine receptorP50130DRD1Sus scrofa (Pig)446
442127D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
442129D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
442130D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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