In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2011 | 20 | Yes |
Popular Name: 1-[4-[3-(diethylamino)propanoyl]piperazin-1-yl]-2-methyl-propan-1-one 1-[4-[3-(diethylamino)propanoyl]…
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) | 1.05 | 7.15 | -49.75 | 1 | 5 | 1 | 45 | 284.424 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.05 | 5.07 | -13.29 | 0 | 5 | 0 | 44 | 283.416 | 6 | ↓ |