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Ligand

NameCHEMBL73661
Molecular formulaC28H40N2O2S
IUPAC name1-[1-[4-(4-tert-butylphenyl)sulfonylphenyl]ethyl]-4-cyclohexylpiperazine
Molecular weight468.7
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP6.2
Synonyms1-[alpha-Methyl-4-(4-tert-butylphenylsulfonyl)benzyl]-4-cyclohexylpiperazine
BDBM50092987
1-{1-[4-(4-tert-Butyl-benzenesulfonyl)-phenyl]-ethyl}-4-cyclohexyl-piperazine
Inchi KeyAHUKWGFWYLCACE-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H40N2O2S/c1-22(29-18-20-30(21-19-29)25-8-6-5-7-9-25)23-10-14-26(15-11-23)33(31,32)27-16-12-24(13-17-27)28(2,3)4/h10-17,22,25H,5-9,18-21H2,1-4H3
PubChem CID44312464
ChEMBLCHEMBL73661
IUPHARN/A
BindingDB50092987
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5893Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
5894Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466

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