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Ligand

NameSCHEMBL9105330
Molecular formulaC17H12ClFN4O
IUPAC name1-(2-chlorophenyl)-N-(diaminomethylidene)-4-fluoroisoquinoline-7-carboxamide
Molecular weight342.758
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP3.4
SynonymsUS8853242, 161
CHEMBL3644534
BDBM135789
Inchi KeyCURBYWXZHSUAHS-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H12ClFN4O/c18-13-4-2-1-3-11(13)15-12-7-9(16(24)23-17(20)21)5-6-10(12)14(19)8-22-15/h1-8H,(H4,20,21,23,24)
PubChem CID50923585
ChEMBLCHEMBL3644534
IUPHARN/A
BindingDB135789
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
510355-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357

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