| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 3rd, 2009 | 25 | Yes |
Popular Name: 2-[4-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]piperazin-1-yl]-N-isopropyl-acetamide 2-[4-[2-[(4-chlorophenyl)methyla…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.20 | 5.1 | -46.06 | 3 | 6 | 1 | 66 | 367.901 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.20 | 5.1 | -44.45 | 3 | 6 | 1 | 66 | 367.901 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.20 | 2.91 | -11.73 | 2 | 6 | 0 | 65 | 366.893 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.20 | 7.36 | -120.71 | 4 | 6 | 2 | 67 | 368.909 | 7 | ↓ |
