In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: 1-(3,4-dimethylphenyl)-2-(4-propylpiperazin-1-yl)ethanone 1-(3,4-dimethylphenyl)-2-(4-prop…
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) | 3.09 | 8.58 | -36.47 | 1 | 3 | 1 | 25 | 275.416 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 6.31 | -7.11 | 0 | 3 | 0 | 24 | 274.408 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 8.51 | -38.74 | 1 | 3 | 1 | 25 | 275.416 | 5 | ↓ |