 |
| Ligand Name:
4-{bis[4-(dimethylamino)phenyl]methyl}phenol |
| HET ID: 1OM |
PubChem:
221110
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: Oc1ccc(cc1)C(c1ccc(cc1)N(C)C)c1ccc(cc1)N(C)C |
| Standard InChI: InChI=1S/C23H26N2O/c1-24(2)20-11-5-17(6-12-20)23(19-9-15-22(26)16-10-19)18-7-13-21(14-8-18)25(3)4/h5-16,23,26H,1-4H3 |
| Molecular Formula: C23H26N2O |
Mol. Weight: 346.46533 |
Heavy Atoms: 26 |
| Charge: 0 |
Is Chiral: False |
logP: 4.7044 |
| HBD: 1 |
HBA: 3 |
TPSA: 26.71 |
| #Bonds: 28 |
#Rotatable Bonds: 5 |
Shape Complexity: 0.2173913 |
| Stereocomplexity: 0.0 |
Ligand Type: Small Molecule |