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Ligand

NameCHEMBL292725
Molecular formulaC21H20N4O2S
IUPAC name8-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene
Molecular weight392.477
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.4
SynonymsBDBM50407762
Inchi KeyOUZIPSMKVVNNRW-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H20N4O2S/c1-2-16-20(22-21-17(5-11-28-21)25(16)6-1)24-9-7-23(8-10-24)13-15-3-4-18-19(12-15)27-14-26-18/h1-6,11-12H,7-10,13-14H2
PubChem CID10739272
ChEMBLCHEMBL292725
IUPHARN/A
BindingDB50407762
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
2509895-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
2509905-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
2509885-hydroxytryptamine receptor 1DP79400HTR1DSus scrofa (Pig)291
2509915-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
2509875-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458

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