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Ligand

NameNSC697162
Molecular formulaC34H38N8O4
IUPAC name2-[[4-amino-5-[8-[4-amino-5-[(1-hydroxynaphthalen-2-yl)oxymethyl]-1,2,4-triazol-3-yl]octyl]-1,2,4-triazol-3-yl]methoxy]naphthalen-1-ol
Molecular weight622.73
Hydrogen bond acceptor10
Hydrogen bond donor4
XlogP6.4
Synonyms2-[[4-amino-5-[8-[4-amino-5-[(1-hydroxynaphthalen-2-yl)oxymethyl]-1,2,4-triazol-3-yl]octyl]-1,2,4-triazol-3-yl]methoxy]naphthalen-1-ol
CHEMBL363587
2,2'-{octane-1,8-diylbis[(4-amino-4h-1,2,4-triazole-5,3-diyl)methanediyloxy]}dinaphthalen-1-ol
NSC-697162
AC1L97G4
[ Show all ]
Inchi KeyOIDAYCSNXVJXMP-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H38N8O4/c35-41-29(37-39-31(41)21-45-27-19-17-23-11-7-9-13-25(23)33(27)43)15-5-3-1-2-4-6-16-30-38-40-32(42(30)36)22-46-28-20-18-24-12-8-10-14-26(24)34(28)44/h7-14,17-20,43-44H,1-6,15-16,21-22,35-36H2
PubChem CID394044
ChEMBLCHEMBL363587
IUPHARN/A
BindingDBN/A
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
241929G-protein coupled receptor 182O15218GPR182Homo sapiens (Human)404

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