| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 23 | Yes |
Popular Name: N-[6-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]-3-pyridyl]-3-methyl-butanamide N-[6-[4-[(2S)-2-hydroxypropyl]pi…
| 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) | 1.76 | 3.28 | -10.41 | 2 | 6 | 0 | 69 | 320.437 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 3.58 | -34.15 | 3 | 6 | 1 | 70 | 321.445 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 5.51 | -42.3 | 3 | 6 | 1 | 70 | 321.445 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 5.83 | -96.45 | 4 | 6 | 2 | 71 | 322.453 | 6 | ↓ |
