Ligand Download |
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Ligand Name: 3-(1-Ethyl-1,1-dimethylhydrazin-1-ium-2-yl)propanoic acid | ||
HET ID: C2T | PubChem: 13794690 | |
DrugBank: - | ChEMBL: - | |
Canonical SMILES: CC[N+](NCCC(=O)O)(C)C | ||
Standard InChI: InChI=1S/C7H16N2O2/c1-4-9(2,3)8-6-5-7(10)11/h8H,4-6H2,1-3H3/p+1 | ||
Molecular Formula: C7H17N2O2+ | Mol. Weight: 161.22208 | Heavy Atoms: 11 |
Charge: 1 | Is Chiral: False | logP: 0.4529 |
HBD: 2 | HBA: 3 | TPSA: 49.33 |
#Bonds: 10 | #Rotatable Bonds: 5 | Shape Complexity: 0.85714287 |
Stereocomplexity: 0.0 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | Binding Affinity | Binding Database | Complex Card |
Gamma-butyrobetaine dioxygenase | O75936 (BODG_HUMAN) | Homo sapiens | 4BHG |
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