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Ligand

NameG-1
Molecular formulaC21H18BrNO3
IUPAC name1-[(3aS,4R,9bR)-4-(6-bromo-1,3-benzodioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]ethanone
Molecular weight412.283
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.6
Synonyms1-[4-(6-bromo-benzo[1,3]dioxol-5-yl)-3-alpha-4,5,9-beta-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]-ethanone
CHEMBL569766
HY-107216
UNM000000675701
925419-53-0
[ Show all ]
Inchi KeyVHSVKVWHYFBIFJ-HKZYLEAXSA-N
Inchi IDInChI=1S/C21H18BrNO3/c1-11(24)12-5-6-18-15(7-12)13-3-2-4-14(13)21(23-18)16-8-19-20(9-17(16)22)26-10-25-19/h2-3,5-9,13-14,21,23H,4,10H2,1H3/t13-,14+,21-/m1/s1
PubChem CID5322399
ChEMBLCHEMBL569766
IUPHAR1014
BindingDB50303803
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
355535G-protein coupled estrogen receptor 1Q99527GPER1Homo sapiens (Human)375

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