| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 22 | Yes |
Popular Name: (2S)-2-amino-3-methyl-1-[4-(2-methylbenzoyl)piperazin-1-yl]butan-1-one (2S)-2-amino-3-methyl-1-[4-(2-me…
| 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) | 0.50 | 5.3 | -52.42 | 3 | 5 | 1 | 68 | 304.414 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.50 | 5.01 | -13.96 | 2 | 5 | 0 | 67 | 303.406 | 3 | ↓ |
