| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 14th, 2009 | 30 | Yes |
Popular Name: N-[(1R,2S)-2-methyl-1-[[6-(3-oxopiperazin-1-yl)-3-pyridyl]carbamoyl]butyl]benzamide N-[(1R,2S)-2-methyl-1-[[6-(3-oxo…
| 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) | 2.39 | 4.58 | -15.85 | 3 | 8 | 0 | 103 | 409.49 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 4.83 | -46.32 | 4 | 8 | 1 | 105 | 410.498 | 7 | ↓ |
