| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 20 | Yes |
Popular Name: (1S,2S)-2-(4-ethylpiperazin-1-yl)-1-(4-methoxyphenyl)propan-1-amine (1S,2S)-2-(4-ethylpiperazin-1-yl…
| 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) | 0.11 | 4.66 | -101.52 | 4 | 4 | 2 | 45 | 279.428 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.11 | 2.35 | -52.02 | 3 | 4 | 1 | 43 | 278.42 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.11 | 4.29 | -121.43 | 4 | 4 | 2 | 45 | 279.428 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.11 | 4.05 | -31.68 | 3 | 4 | 1 | 43 | 278.42 | 5 | ↓ |
