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Ligand

NameCHEMBL2152746
Molecular formulaC25H34N6OS
IUPAC name[4-[2-[(2-amino-4,5,6,7-tetrahydro-1,3-benzothiazol-6-yl)-propylamino]ethyl]piperazin-1-yl]-(1H-indol-2-yl)methanone
Molecular weight466.648
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.8
SynonymsBDBM50392125
Inchi KeyCPWJJWMVFFZCGJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H34N6OS/c1-2-9-30(19-7-8-21-23(17-19)33-25(26)28-21)13-10-29-11-14-31(15-12-29)24(32)22-16-18-5-3-4-6-20(18)27-22/h3-6,16,19,27H,2,7-15,17H2,1H3,(H2,26,28)
PubChem CID60165801
ChEMBLCHEMBL2152746
IUPHARN/A
BindingDB50392125
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
47770D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
47772D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
47769D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446
47771D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400

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