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Ligand

NameCHEMBL1085535
Molecular formulaC11H12N6
IUPAC name(2R,3R,4R)-3-cyclopropyl-7-(2H-tetrazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene
Molecular weight228.259
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP1.0
Synonyms(4aR,5R,5aR)-5-cyclopropyl-3-(1H-tetrazol-5-yl)-4,4a,5,5a-tetrahydro-1H-cyclopropa[4,5]cyclopenta[1,2-c]pyrazole
BDBM50318900
Inchi KeyBUTFUADABNFVEZ-LPBLVHEISA-N
Inchi IDInChI=1S/C11H12N6/c1-2-4(1)7-5-3-6-9(8(5)7)12-13-10(6)11-14-16-17-15-11/h4-5,7-8H,1-3H2,(H,12,13)(H,14,15,16,17)/t5-,7-,8-/m1/s1
PubChem CID46889340
ChEMBLCHEMBL1085535
IUPHARN/A
BindingDB50318900
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
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GLASS IDNameUniProtGeneSpeciesLength
33355Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363

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