| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 16 | Yes |
Popular Name: 4-[(1S)-2-amino-1-(4-bromo-2-thienyl)ethyl]piperazin-2-one 4-[(1S)-2-amino-1-(4-bromo-2-thi…
| 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) | 0.83 | -0.19 | -58.44 | 4 | 4 | 1 | 60 | 305.221 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.83 | -1.02 | -7.68 | 3 | 4 | 0 | 58 | 304.213 | 3 | ↓ |
