| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 16 | Yes |
Popular Name: 3-[4-[(2S)-3-amino-2-methyl-propyl]piperazin-1-yl]propanamide 3-[4-[(2S)-3-amino-2-methyl-prop…
| 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) | -1.21 | -0.79 | -111.39 | 6 | 5 | 2 | 78 | 230.356 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.21 | -3.15 | -7.66 | 4 | 5 | 0 | 76 | 228.34 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.21 | -0.52 | -96.19 | 6 | 5 | 2 | 78 | 230.356 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.21 | -2.77 | -49.69 | 5 | 5 | 1 | 77 | 229.348 | 6 | ↓ |
