| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 21 | Yes |
Popular Name: (1S)-1-(4-isopropylphenyl)-2-(4-propylpiperazin-1-yl)ethanamine (1S)-1-(4-isopropylphenyl)-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) | 1.74 | 8.2 | -103.09 | 4 | 3 | 2 | 35 | 291.483 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 5.89 | -43.5 | 3 | 3 | 1 | 34 | 290.475 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 5.6 | -1.63 | 2 | 3 | 0 | 32 | 289.467 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | 7.52 | -34.11 | 3 | 3 | 1 | 34 | 290.475 | 6 | ↓ |
