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Ligand

NameCHEMBL2057760
Molecular formulaC34H39FN4O2
IUPAC nameN-[(1R,5R)-8-[(6-fluoronaphthalen-2-yl)methyl]-8-azabicyclo[3.2.1]octan-3-yl]-4-(1-phenylcyclopropanecarbonyl)-1,4-diazepane-1-carboxamide
Molecular weight554.71
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.2
SynonymsBDBM50387658
SCHEMBL18841106
Inchi KeyALNPYJIMVMNPSZ-FIRIVFDPSA-N
Inchi IDInChI=1S/C34H39FN4O2/c35-28-10-9-25-19-24(7-8-26(25)20-28)23-39-30-11-12-31(39)22-29(21-30)36-33(41)38-16-4-15-37(17-18-38)32(40)34(13-14-34)27-5-2-1-3-6-27/h1-3,5-10,19-20,29-31H,4,11-18,21-23H2,(H,36,41)/t30-,31-/m1/s1
PubChem CID70692666
ChEMBLCHEMBL2057760
IUPHARN/A
BindingDB50387658
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
8435C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355

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