Ligand Download |
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Ligand Name: [2-(1-methyl-1,2,3,4-tetrazol-4-ium-5-yl)ethanoylamino]azanium | ||
HET ID: BWK | PubChem: 137332070 | |
DrugBank: - | ChEMBL: - | |
Canonical SMILES: [NH3+]NC(=O)Cc1[nH+]nnn1C | ||
Standard InChI: InChI=1S/C4H8N6O/c1-10-3(7-8-9-10)2-4(11)6-5/h2,5H2,1H3,(H,6,11)/p+2 | ||
Molecular Formula: C4H10N6O++ | Mol. Weight: 158.1618 | Heavy Atoms: 11 |
Charge: 2 | Is Chiral: False | logP: -3.1643 |
HBD: 3 | HBA: 5 | TPSA: 101.59 |
#Bonds: 15 | #Rotatable Bonds: 3 | Shape Complexity: 0.5 |
Stereocomplexity: 0.0 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | Binding Affinity | Binding Database | Complex Card |
Lysine-specific demethylase 4D | Q6B0I6 (KDM4D_HUMAN) | Homo sapiens | 6ETE |
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