| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 31 | Yes |
Popular Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide N-[2-(4-benzylpiperazin-1-yl)eth…
| 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) | 1.93 | 7.76 | -45.85 | 2 | 7 | 1 | 66 | 423.537 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 2.86 | -12.02 | 1 | 7 | 0 | 69 | 422.529 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.93 | 7.55 | -51.89 | 2 | 7 | 1 | 66 | 423.537 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.93 | 5.17 | -15.02 | 1 | 7 | 0 | 65 | 422.529 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 5.13 | -41.03 | 2 | 7 | 1 | 70 | 423.537 | 8 | ↓ |
