| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 21 | Yes |
Popular Name: (3S)-4-(4-ethylphenoxy)-3-(4-methylpiperazin-1-yl)butan-1-amine (3S)-4-(4-ethylphenoxy)-3-(4-met…
| 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) | 1.89 | 5.64 | -94.23 | 4 | 4 | 2 | 45 | 293.455 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.89 | 5.5 | -109 | 4 | 4 | 2 | 45 | 293.455 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.89 | 3.16 | -46.48 | 3 | 4 | 1 | 43 | 292.447 | 7 | ↓ |
