| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2010 | 24 | Yes |
Popular Name: [4-[(4-isopropylphenyl)methyl]piperazin-1-yl]-(3-pyridyl)methanone [4-[(4-isopropylphenyl)methyl]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) | 2.47 | 7.8 | -10.15 | 0 | 4 | 0 | 36 | 323.44 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 9.91 | -46.16 | 1 | 4 | 1 | 38 | 324.448 | 4 | ↓ |
