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Ligand

NameCHEMBL3946708
Molecular formulaC34H43ClN4O2
IUPAC name1-(4-tert-butylphenyl)-3-[2-[4-chloro-1'-(2,2-dimethylpropyl)-7-hydroxyspiro[2H-indole-3,4'-piperidine]-1-yl]phenyl]urea
Molecular weight575.194
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP8.2
SynonymsSCHEMBL16782835
US9428504, 55
BDBM245315
Inchi KeyAIPUGEMWZTUKDW-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H43ClN4O2/c1-32(2,3)21-38-19-17-34(18-20-38)22-39(30-28(40)16-15-25(35)29(30)34)27-10-8-7-9-26(27)37-31(41)36-24-13-11-23(12-14-24)33(4,5)6/h7-16,40H,17-22H2,1-6H3,(H2,36,37,41)
PubChem CID118130651
ChEMBLCHEMBL3946708
IUPHARN/A
BindingDB245315
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
533932P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373

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