In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 16 | Yes |
Popular Name: 1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]propan-1-one 1-[4-[2-(dimethylamino)acetyl]pi…
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) | -0.21 | 4.8 | -43.87 | 1 | 5 | 1 | 45 | 228.316 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.21 | 2.41 | -11.52 | 0 | 5 | 0 | 44 | 227.308 | 3 | ↓ |