Ligand |
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Ligand Name: Acetyl 6-formylpterin | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB171 | PubChem: 135447887 | |
Synonym(s): - | ||
DrugBank: - | ChEMBL: CHEMBL1742248 | |
Canonical SMILES: CC(=O)NC1=NC(=O)C2=C(N1)N=CC(C=O)=N2 | ||
Standard InChI: InChI=1S/C9H7N5O3/c1-4(16)11-9-13-7-6(8(17)14-9)12-5(3-15)2-10-7/h2-3H,1H3,(H2,10,11,13,14,16,17) | ||
Molecular Formula: C9H7N5O3 | Mol. Weight: 232.179 | logP: 0.8 |
HBD: 1 | HBA: 7 | |
#Rotatable Bonds: 2 | TPSA: 114.8 |