Ligand Data

Ligand

id 1007
Name compound 2 [PMID: 28379944]
SMILES CCCc1nc2c(cc(cc2)N(Cc2ccco2)C(=O)c2ccccc2)c(=O)n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1
InChIKey SYDVEZUPFQXMSM-UHFFFAOYSA-N
Type small-molecule
External Links
Structure pdb 5UNH

Structure

Properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 10
Molecular weight 621.2


Bioactivity

Receptor Affinity (nM) Potency (nM)
GTP Uniprot Species Family Class Min Avg Max Min Avg Max