 |
| Ligand Name: PCM-0102962 |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB1404 |
PubChem:
2050220
|
Synonym(s):
- 2-chloro-1-[4-(4-methylbenzoyl)piperazin-1-yl]ethan-1-one
- 693790-62-4
- zinc2456290
- akos003587807
- z1562125490
show 4 synonym(s)
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: Cc1ccc(cc1)C(=O)N2CCN(CC2)C(=O)CCl |
| Standard InChI: InChI=1S/C14H17ClN2O2/c1-11-2-4-12(5-3-11)14(19)17-8-6-16(7-9-17)13(18)10-15/h2-5H,6-10H2,1H3 |
| Molecular Formula: C14H17ClN2O2 |
Mol. Weight: 280.09787 |
logP: 1.51822 |
| HBD: 0 | HBA: 2 |
| #Rotatable Bonds: 2 | TPSA: 40.62 |