| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 30th, 2008 | 24 | Yes |
Popular Name: (2S)-1-[[3-(3-chlorophenyl)-1-methyl-pyrazol-4-yl]methyl]-2-isopropyl-4-methyl-piperazine (2S)-1-[[3-(3-chlorophenyl)-1-me…
| 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) | 3.45 | 9.97 | -43.33 | 1 | 4 | 1 | 26 | 347.914 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.45 | 8.07 | -6.06 | 0 | 4 | 0 | 24 | 346.906 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.45 | 8.71 | -37.96 | 1 | 4 | 1 | 26 | 347.914 | 4 | ↓ |
