| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 28 | Yes |
Popular Name: (3S)-4-isopentyl-3-[2-oxo-2-[4-(3-pyridylmethyl)piperazin-1-yl]ethyl]piperazin-2-one (3S)-4-isopentyl-3-[2-oxo-2-[4-(…
| 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) | 1.85 | 5.83 | -42.78 | 2 | 7 | 1 | 70 | 388.536 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.85 | 4.29 | -12.66 | 1 | 7 | 0 | 69 | 387.528 | 7 | ↓ |
