Ligand Download |
||
Ligand Name: 2-(3,4-dichlorophenyl)ethanamine | ||
HET ID: 42J | PubChem: 217958 | |
DrugBank: - | ChEMBL: CHEMBL147230 | |
Canonical SMILES: NCCc1ccc(c(c1)Cl)Cl | ||
Standard InChI: InChI=1S/C8H9Cl2N/c9-7-2-1-6(3-4-11)5-8(7)10/h1-2,5H,3-4,11H2 | ||
Molecular Formula: C8H9Cl2N | Mol. Weight: 190.06976 | Heavy Atoms: 11 |
Charge: 0 | Is Chiral: False | logP: 3.1949 |
HBD: 1 | HBA: 1 | TPSA: 26.02 |
#Bonds: 11 | #Rotatable Bonds: 2 | Shape Complexity: 0.25 |
Stereocomplexity: 0.0 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | Binding Affinity | Binding Database | Complex Card |
Sodium-dependent dopamine transporter | Q7K4Y6 (DAT_DROME) | Drosophila melanogaster | 4XPA |
- |
- |
SHOW |