| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 17 | Yes |
Popular Name: 4-[(1S,2R)-2-amino-1-(5-chloro-2-thienyl)propyl]piperazin-2-one 4-[(1S,2R)-2-amino-1-(5-chloro-2…
| 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) | 1.30 | 0.76 | -52.95 | 4 | 4 | 1 | 60 | 274.797 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.30 | 0.51 | -7.28 | 3 | 4 | 0 | 58 | 273.789 | 3 | ↓ |
