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Ligand

NameCHEMBL90298
Molecular formulaC19H23N5O3
IUPAC nameN-[(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)methyl]benzamide
Molecular weight369.425
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.4
SynonymsBDBM50039690
N-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-ylmethyl)-benzamide
Inchi KeyAJDXMOPDXIREQH-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H23N5O3/c1-3-10-23-16-15(18(26)24(11-4-2)19(23)27)21-14(22-16)12-20-17(25)13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3,(H,20,25)(H,21,22)
PubChem CID10067676
ChEMBLCHEMBL90298
IUPHARN/A
BindingDB50039690
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
6821Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326

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