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GPCR

Name5-hydroxytryptamine receptor 1D
SpeciesSus scrofa (Pig)
GeneHTR1D
Synonym5-HT-1D
5-HT1D
Serotonin receptor 1D
DiseaseN/A for non-human GPCRs
Length291
Amino acid sequenceAMTDLLVSILVMPISIPYTITQTWSFGQLLCDIWLSSDITCCTASILHLCVIALDRYWAITDALEYSKRRTAGHAAAMIAIVWAISICISIPPLFWRQARAHEEISDCLVNTSQISYTIYSTCGAFYIPSLLLIILYGRIYRAARNRILNPPSLYGKRFTTAHLITGSAGSSLCSLNPSLHEGHSHSAGSPLFFNHVKIKLADSVLERKRISAARERKATKTLGIILGAFIICWLPFFVASLVLPICRDSCWIHPALFDFFTWLGYLNSLINPIIYTVFNEEFRQAFQKVV
UniProtP79400
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4105
IUPHARN/A
DrugBankN/A

Ligand

Name23869-98-9
Molecular formulaC16H24N2O2
IUPAC name1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-ol
Molecular weight276.38
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP2.5
Synonyms2-Debenzoyl rac Bopindolol
1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]-2-propanol
4-(2-Hydroxy-3-tert-butylaminopropoxy)-2-methylindole
62658-85-9
1-((2-Methyl-1H-indol-4-yl)oxy)-3-(tert-butylamino)propan-2-ol
[ Show all ]
Inchi KeyBGQHPLYSXBZMQG-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H24N2O2/c1-11-8-13-14(18-11)6-5-7-15(13)20-10-12(19)9-17-16(2,3)4/h5-8,12,17-19H,9-10H2,1-4H3
PubChem CID152662
ChEMBLN/A
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
Ki3890.0 nMWaeber et al., PMID1988, Schlicker et al., PMID1989PDSP

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