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Ligand

NameCHEMBL3979906
Molecular formulaC23H30FN5O3S
IUPAC name1-[3-[4-(3-fluorophenyl)sulfonylpiperidin-1-yl]-2-(propan-2-ylamino)-7,8-dihydro-5H-pyrido[3,4-b]pyrazin-6-yl]ethanone
Molecular weight475.583
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP2.3
SynonymsBDBM191007
SCHEMBL16818374
US9181249, 120
Inchi KeyDMHZAYPNRXURFS-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H30FN5O3S/c1-15(2)25-22-23(27-21-14-29(16(3)30)12-9-20(21)26-22)28-10-7-18(8-11-28)33(31,32)19-6-4-5-17(24)13-19/h4-6,13,15,18H,7-12,14H2,1-3H3,(H,25,26)
PubChem CID118159384
ChEMBLCHEMBL3979906
IUPHARN/A
BindingDB191007
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
517645G-protein coupled receptor 6P46095GPR6Homo sapiens (Human)362

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