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Ligand

NameCHEMBL180233
Molecular formulaC35H41F2N3O4
IUPAC namepropan-2-yl N-[4-[4-[4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]butoxy]phenyl]but-3-ynyl]-N-hydroxycarbamate
Molecular weight605.727
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP6.7
SynonymsBDBM50160829
Inchi KeyAITHPZKEMCVCDZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C35H41F2N3O4/c1-27(2)44-35(41)40(42)21-4-3-7-28-8-18-33(19-9-28)43-26-6-5-20-38-22-24-39(25-23-38)34(29-10-14-31(36)15-11-29)30-12-16-32(37)17-13-30/h8-19,27,34,42H,4-6,20-26H2,1-2H3
PubChem CID44389292
ChEMBLCHEMBL180233
IUPHARN/A
BindingDB50160829
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
6507Histamine H1 receptorP35367HRH1Homo sapiens (Human)487

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