| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2011 | 21 | Yes |
Popular Name: (2S)-2-amino-3-(4-tert-butylpiperazin-1-yl)-2-phenyl-propan-1-ol (2S)-2-amino-3-(4-tert-butylpipe…
| 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 | 3.11 | -94.42 | 5 | 4 | 2 | 56 | 293.455 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.85 | 0.99 | -43.12 | 4 | 4 | 1 | 54 | 292.447 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.85 | 1.38 | -3.58 | 3 | 4 | 0 | 53 | 291.439 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.85 | 2.92 | -29.06 | 4 | 4 | 1 | 54 | 292.447 | 5 | ↓ |
