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Ligand

NameMLS000677316
Molecular formulaC17H11N3O5
IUPAC name3-nitro-N-[(E)-(4-oxochromen-3-yl)methylideneamino]benzamide
Molecular weight337.291
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.5
SynonymsBDBM60151
cid_1085155
SMR000286141
3-nitro-N-[(4-oxochromen-3-yl)methylideneamino]benzamide
3-nitro-N-[(4-oxidanylidenechromen-3-yl)methylideneamino]benzamide
[ Show all ]
Inchi KeyCYNDOHUWRYPYCT-GIJQJNRQSA-N
Inchi IDInChI=1S/C17H11N3O5/c21-16-12(10-25-15-7-2-1-6-14(15)16)9-18-19-17(22)11-4-3-5-13(8-11)20(23)24/h1-10H,(H,19,22)/b18-9+
PubChem CID9617885
ChEMBLCHEMBL3189482
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
53688Thyrotropin-releasing hormone receptorP34981TRHRHomo sapiens (Human)398

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