Ligand |
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| Ligand Name: 9-METHYLGUANINE | ||
| HET ID: 9MG | PubChem: 135403591 | |
| DrugBank: DB02489 | ChEMBL: CHEMBL1230674 | |
| Canonical SMILES: Nc1nc(O)c2c(n1)n(C)cn2 | ||
| Standard InChI: InChI=1S/C6H7N5O/c1-11-2-8-3-4(11)9-6(7)10-5(3)12/h2H,1H3,(H3,7,9,10,12) | ||
| Molecular Formula: C6H7N5O | Mol. Weight: 165.15268 | Heavy Atoms: 12 |
| Charge: 0 | Is Chiral: False | logP: 0.2323 |
| HBD: 2 | HBA: 6 | TPSA: 89.85 |
| #Bonds: 13 | #Rotatable Bonds: 0 | Shape Complexity: 0.16666667 |
| Stereocomplexity: 0.0 | Ligand Type: Small Molecule | |
Binding Affinity |
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