Ligand |
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Ligand Name: TD-7 | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB864 | PubChem: 90659691 | |
Synonym(s):
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DrugBank: - | ChEMBL: - | |
Canonical SMILES: COc1ccc(c(C=O)c1)OCc2cccc(n2)CO | ||
Standard InChI: InChI=1S/C15H15NO4/c1-19-14-5-6-15(11(7-14)8-17)20-10-13-4-2-3-12(9-18)16-13/h2-8,18H,9-10H2,1H3 | ||
Molecular Formula: C15H15NO4 | Mol. Weight: 273.1001 | logP: 1.974 |
HBD: 1 | HBA: 5 | |
#Rotatable Bonds: 6 | TPSA: 68.65 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Hemoglobin subunit alpha | P69905 (HBA_HUMAN) | Homo sapiens (Human) | 6DI4 | GJ1 |
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