| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 13th, 2009 | 24 | Yes |
Popular Name: N-[6-[4-[(2S)-2-hydroxybutyl]piperazin-1-yl]-3-pyridyl]-3-methyl-butanamide N-[6-[4-[(2S)-2-hydroxybutyl]pip…
| 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) | 2.27 | 4.1 | -10.24 | 2 | 6 | 0 | 69 | 334.464 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 4.41 | -33.58 | 3 | 6 | 1 | 70 | 335.472 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 6.32 | -42.51 | 3 | 6 | 1 | 70 | 335.472 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.27 | 6.65 | -97.6 | 4 | 6 | 2 | 71 | 336.48 | 7 | ↓ |
