| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 18 | Yes |
Popular Name: (2S)-1-(4-tert-butylpiperazin-1-yl)-3-(cyclopropylamino)propan-2-ol (2S)-1-(4-tert-butylpiperazin-1-…
| 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) | 0.93 | 2.69 | -80.79 | 4 | 4 | 2 | 45 | 257.422 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.93 | 0.58 | -36.37 | 3 | 4 | 1 | 43 | 256.414 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.93 | 2.86 | -101.32 | 4 | 4 | 2 | 45 | 257.422 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.93 | 5.06 | -191.44 | 5 | 4 | 3 | 46 | 258.43 | 6 | ↓ |
