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Ligand

NameCHEMBL65974
Molecular formulaC14H16N4S
IUPAC name8-(4-methylpiperazin-1-yl)-3-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,7,9,11-pentaene
Molecular weight272.37
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.1
SynonymsBDBM50407767
SCHEMBL7305667
5-(4-Methyl-1-piperazinyl)pyrrolo[1,2-a]thieno[3,2-e]pyrazine
Inchi KeyOYQJNUJWLVFCPE-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H16N4S/c1-16-6-8-17(9-7-16)13-12-3-2-5-18(12)14-11(15-13)4-10-19-14/h2-5,10H,6-9H2,1H3
PubChem CID10516340
ChEMBLCHEMBL65974
IUPHARN/A
BindingDB50407767
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2535055-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
2535065-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
2535025-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
2535045-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
2535035-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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