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Ligand

NameSMR000043948
Molecular formulaC21H16N4O3S
IUPAC name3-(benzenesulfonyl)-1-(furan-2-ylmethyl)pyrrolo[3,2-b]quinoxalin-2-amine
Molecular weight404.444
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.1
Synonyms3-(benzenesulfonyl)-1-(2-furanylmethyl)-2-pyrrolo[3,2-b]quinoxalinamine
cid_663121
regid861895
AC1LD8T7
MCULE-9715759587
[ Show all ]
Inchi KeyCYWCPVXKHNAXDK-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H16N4O3S/c22-20-19(29(26,27)15-8-2-1-3-9-15)18-21(25(20)13-14-7-6-12-28-14)24-17-11-5-4-10-16(17)23-18/h1-12H,13,22H2
PubChem CID663121
ChEMBLCHEMBL1529652
IUPHARN/A
BindingDBN/A
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
53990Thyrotropin-releasing hormone receptorP34981TRHRHomo sapiens (Human)398

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