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Ligand

NameCHEMBL1257214
Molecular formulaC23H28FN5S2
IUPAC name5-[5-[3-(5-fluorospiro[1,2-dihydroindene-3,3'-pyrrolidine]-1'-yl)propylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-2,4-dimethyl-1,3-thiazole
Molecular weight457.63
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.6
SynonymsBDBM50417131
SCHEMBL2501676
Inchi KeyAEUDDHALUDWNEZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H28FN5S2/c1-15-20(31-16(2)25-15)21-26-27-22(28(21)3)30-12-4-10-29-11-9-23(14-29)8-7-17-5-6-18(24)13-19(17)23/h5-6,13H,4,7-12,14H2,1-3H3
PubChem CID24758945
ChEMBLCHEMBL1257214
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3838D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
3839D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400

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