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Ligand

NameMLS000325386
Molecular formulaC17H13BrClN5O4
IUPAC nameN-[(Z)-(3-bromophenyl)methylideneamino]-5-[(4-chloro-5-methyl-3-nitropyrazol-1-yl)methyl]furan-2-carboxamide
Molecular weight466.676
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.1
SynonymsN'-(3-bromobenzylidene)-5-({4-chloro-3-nitro-5-methyl-1H-pyrazol-1-yl}methyl)-2-furohydrazide
SMR000159511
AC1NTKDQ
CHEMBL3198312
MolPort-002-820-013
[ Show all ]
Inchi KeyABCXJIGKWRYVEV-ZBKNUEDVSA-N
Inchi IDInChI=1S/C17H13BrClN5O4/c1-10-15(19)16(24(26)27)22-23(10)9-13-5-6-14(28-13)17(25)21-20-8-11-3-2-4-12(18)7-11/h2-8H,9H2,1H3,(H,21,25)/b20-8-
PubChem CID5431585
ChEMBLCHEMBL3198312
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
750Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
751Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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