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Ligand

NameCHEMBL98388
Molecular formulaC20H20FNO4
IUPAC nameN-[(3S,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-4-fluorobenzamide
Molecular weight357.381
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.3
SynonymsBDBM50217180
SCHEMBL3301548
Inchi KeyRCLXAPJEFHPYEG-ROUUACIJSA-N
Inchi IDInChI=1S/C20H20FNO4/c1-11(23)13-6-9-16-15(10-13)17(18(24)20(2,3)26-16)22-19(25)12-4-7-14(21)8-5-12/h4-10,17-18,24H,1-3H3,(H,22,25)/t17-,18-/m0/s1
PubChem CID44330234
ChEMBLCHEMBL98388
IUPHARN/A
BindingDB50217180
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
2928435-hydroxytryptamine receptor 1DP28565Htr1dRattus norvegicus (Rat)374
2928445-hydroxytryptamine receptor 1DQ61224Htr1dMus musculus (Mouse)374

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