Ligand

Download

Ligand Name:   URACIL
HET ID:   URA PubChem:   1174, 5274267
DrugBank:   DB03419 ChEMBL:   CHEMBL566
Canonical SMILES:   O=c1cc[nH]c(=O)[nH]1
Standard InChI:   InChI=1S/C4H4N2O2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)
Molecular Formula:   C4H4N2O2 Mol. Weight:   112.08676 Heavy Atoms:   8
Charge:   0 Is Chiral:   False logP:   -0.9368
HBD:   2 HBA:   2 TPSA:   65.72
#Bonds:   10 #Rotatable Bonds:   0 Shape Complexity:   0.0
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
HTH-type transcriptional regulator RutR P0ACU2 (RUTR_ECOLI) Escherichia coli 3LOC
-
-
SHOW