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Ligand

NameCHEMBL1076276
Molecular formulaC22H26N4S2
IUPAC nameN-[2-[4-[[(4R)-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-yl]amino]phenyl]ethyl]-1,3-benzothiazol-2-amine
Molecular weight410.598
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP6.2
SynonymsSCHEMBL14000943
BDBM50312029
(R)-N-(4-(4-isobutyl-4,5-dihydrothiazol-2-ylamino)phenethyl)benzo[d]thiazol-2-amine
Inchi KeyAAXLOBRJGXXFQF-GOSISDBHSA-N
Inchi IDInChI=1S/C22H26N4S2/c1-15(2)13-18-14-27-22(25-18)24-17-9-7-16(8-10-17)11-12-23-21-26-19-5-3-4-6-20(19)28-21/h3-10,15,18H,11-14H2,1-2H3,(H,23,26)(H,24,25)/t18-/m1/s1
PubChem CID46879692
ChEMBLCHEMBL1076276
IUPHARN/A
BindingDB50312029
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
601Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384

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