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Ligand

NameCHEMBL3654211
Molecular formulaC17H14F4N4O
IUPAC nameN-(diaminomethylidene)-5-fluoro-8-(2,4,5-trifluorophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
Molecular weight366.32
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.7
SynonymsUS8962612, 79
BDBM148168
SCHEMBL16518328
Inchi KeyAVDREBJNPWVTEF-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H14F4N4O/c18-12-2-1-8(10-5-14(20)15(21)6-13(10)19)11-7-25(4-3-9(11)12)17(26)24-16(22)23/h1-2,5-6H,3-4,7H2,(H4,22,23,24,26)
PubChem CID60150903
ChEMBLCHEMBL3654211
IUPHARN/A
BindingDB148168
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
152045-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357

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