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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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Ligand

NameL-741604
Molecular formulaC14H17N5
IUPAC nameN,N-dimethyl-2-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]ethanamine
Molecular weight255.325
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP0.7
SynonymsCHEMBL296161
D00NLD
SCHEMBL6943364
IGNXHSPBUUSUHB-UHFFFAOYSA-N
BDBM50060426
[ Show all ]
Inchi KeyIGNXHSPBUUSUHB-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H17N5/c1-18(2)6-5-11-8-15-14-4-3-12(7-13(11)14)19-9-16-17-10-19/h3-4,7-10,15H,5-6H2,1-2H3
PubChem CID9881526
ChEMBLCHEMBL296161
IUPHARN/A
BindingDB50060426
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1327015-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
1327005-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
1326985-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
1327035-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
1326995-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
1327025-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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