In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 21 | Yes |
Popular Name: (2S)-1-(2,4-dichlorophenyl)-2-(4-propylpiperazin-1-yl)propan-1-one (2S)-1-(2,4-dichlorophenyl)-2-(4…
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) | 3.87 | 8.75 | -37.87 | 1 | 3 | 1 | 25 | 330.279 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.87 | 6.49 | -6.88 | 0 | 3 | 0 | 24 | 329.271 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.87 | 8.66 | -39.22 | 1 | 3 | 1 | 25 | 330.279 | 5 | ↓ |