hypoxanthine   Click here for help

GtoPdb Ligand ID: 4555

PDB Ligand
Click here for help
2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 0
Topological polar surface area 74.43
Molecular weight 136.04
XLogP 1.44
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Click here for help
Canonical SMILES O=c1nc[nH]c2c1[nH]cn2
Isomeric SMILES O=c1nc[nH]c2c1[nH]cn2
InChI InChI=1S/C5H4N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10)
InChI Key FDGQSTZJBFJUBT-UHFFFAOYSA-N
Transporters Moving this Compound Across a Lipid Membrane
Transporter EC number Reaction Reference
Equilibrative nucleoside transporter 2
Equilibrative nucleoside transporter 1 2
Sodium-dependent nucleobase transporter 1
Additional information and targets (data relate to human unless otherwise stated)
Description Data Reference