| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 18 | Yes |
Popular Name: (3S)-3-amino-1-(4-methylpiperazin-1-yl)-3-phenyl-propan-1-one (3S)-3-amino-1-(4-methylpiperazi…
| 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) | -1.06 | 3.23 | -41.81 | 3 | 4 | 1 | 51 | 248.35 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.06 | 2.87 | -8.24 | 2 | 4 | 0 | 50 | 247.342 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.06 | 5.62 | -97 | 4 | 4 | 2 | 52 | 249.358 | 3 | ↓ |
