| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 21 | Yes |
Popular Name: [4-(4-isopropylpiperazin-1-yl)-2-(trifluoromethyl)phenyl]methanamine [4-(4-isopropylpiperazin-1-yl)-2…
| 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) | 2.61 | 6.86 | -91.36 | 4 | 3 | 2 | 35 | 303.372 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.61 | 4.24 | -4.12 | 2 | 3 | 0 | 32 | 301.356 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.61 | 4.49 | -46.98 | 3 | 3 | 1 | 34 | 302.364 | 4 | ↓ |
