In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 16 | Yes |
Popular Name: N-[3-(dimethylamino)propyl]-2-(piperazin-1-yl)acetamide N-[3-(dimethylamino)propyl]-2-(p…
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) | -0.45 | 1.41 | -85.43 | 4 | 5 | 2 | 53 | 230.356 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.45 | 0.05 | -44.89 | 3 | 5 | 1 | 49 | 229.348 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.45 | 3.7 | -174.44 | 5 | 5 | 3 | 55 | 231.364 | 6 | ↓ |