| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 27 | Yes |
Popular Name: N-[6-[4-[(2S)-2-hydroxy-3-isopropoxy-propyl]piperazin-1-yl]-3-pyridyl]-3-methyl-butanamide N-[6-[4-[(2S)-2-hydroxy-3-isopro…
| 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) | 2.11 | 4.24 | -11.72 | 2 | 7 | 0 | 78 | 378.517 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 4.57 | -35.99 | 3 | 7 | 1 | 79 | 379.525 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 6.48 | -45.34 | 3 | 7 | 1 | 79 | 379.525 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.11 | 6.82 | -101.54 | 4 | 7 | 2 | 80 | 380.533 | 9 | ↓ |
