 |
| Ligand Name:
3-[(2~{R})-5,5-dimethyl-2-phenyl-morpholin-4-yl]-~{N}-(methylcarbamoyl)propanamide |
| HET ID: P0Z |
PubChem:
36689627
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: CC1(C)NC[C@H](OC1)c1ccccc1 |
| Standard InChI: InChI=1S/C12H17NO/c1-12(2)9-14-11(8-13-12)10-6-4-3-5-7-10/h3-7,11,13H,8-9H2,1-2H3/t11-/m0/s1 |
| Molecular Formula: C12H17NO |
Mol. Weight: 191.26949 |
Heavy Atoms: 14 |
| Charge: 0 |
Is Chiral: True |
logP: 2.4549 |
| HBD: 1 |
HBA: 2 |
TPSA: 21.26 |
| #Bonds: 16 |
#Rotatable Bonds: 1 |
Shape Complexity: 0.5 |
| Stereocomplexity: 0.083333336 |
Ligand Type: Small Molecule |