 |
| Ligand Name:
N,N-dimethyl-1-(5-phenylmethoxy-1H-indol-3-yl)methanamine |
| HET ID: DJU |
PubChem:
73814
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: CN(Cc1c[nH]c2c1cc(OCc1ccccc1)cc2)C |
| Standard InChI: InChI=1S/C18H20N2O/c1-20(2)12-15-11-19-18-9-8-16(10-17(15)18)21-13-14-6-4-3-5-7-14/h3-11,19H,12-13H2,1-2H3 |
| Molecular Formula: C18H20N2O |
Mol. Weight: 280.3642 |
Heavy Atoms: 21 |
| Charge: 0 |
Is Chiral: False |
logP: 3.8085 |
| HBD: 1 |
HBA: 2 |
TPSA: 28.26 |
| #Bonds: 24 |
#Rotatable Bonds: 5 |
Shape Complexity: 0.22222222 |
| Stereocomplexity: 0.0 |
Ligand Type: Small Molecule |