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Ligand

NameSCHEMBL15596915
Molecular formulaC34H43FN4O2
IUPAC name1-[2-(3,3-diethyl-4-fluoro-7-hydroxy-2H-indol-1-yl)phenyl]-3-[4-[1-(2,2-dimethylpropyl)pyrrolidin-2-yl]phenyl]urea
Molecular weight558.742
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP7.6
SynonymsUS9540323, 29
Inchi KeyCAFGIGRYRMVNGI-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H43FN4O2/c1-6-34(7-2)22-39(31-29(40)19-18-25(35)30(31)34)28-12-9-8-11-26(28)37-32(41)36-24-16-14-23(15-17-24)27-13-10-20-38(27)21-33(3,4)5/h8-9,11-12,14-19,27,40H,6-7,10,13,20-22H2,1-5H3,(H2,36,37,41)
PubChem CID90062924
ChEMBLN/A
IUPHARN/A
BindingDB260843
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
558407P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373

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