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Ligand

NameCHEMBL3771373
Molecular formulaC15H21N5
IUPAC name4-N-(4-methylphenyl)-1,3,5-triazaspiro[5.5]undeca-1,4-diene-2,4-diamine
Molecular weight271.368
Hydrogen bond acceptor2
Hydrogen bond donor3
XlogP2.0
SynonymsAC1M4UQN
BDBM50148839
MolPort-002-183-253
4-N-(4-methylphenyl)-1,3,5-triazaspiro[5.5]undeca-1,3-diene-2,4-diamine
CCG-22548
[ Show all ]
Inchi KeyATHVBUBNYPMQAA-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H21N5/c1-11-5-7-12(8-6-11)17-14-18-13(16)19-15(20-14)9-3-2-4-10-15/h5-8H,2-4,9-10H2,1H3,(H4,16,17,18,19,20)
PubChem CID2267399
ChEMBLCHEMBL3771373
IUPHARN/A
BindingDB50148839
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
5218695-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481

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