| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 18 | Yes |
Popular Name: (1S)-1-(2-methoxyphenyl)-2-(4-methylpiperazin-1-yl)ethanamine (1S)-1-(2-methoxyphenyl)-2-(4-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) | -0.64 | 4.28 | -99.21 | 4 | 4 | 2 | 45 | 251.374 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.64 | 1.56 | -3.51 | 2 | 4 | 0 | 42 | 249.358 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.64 | 3.48 | -31.56 | 3 | 4 | 1 | 43 | 250.366 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.64 | 1.81 | -42.92 | 3 | 4 | 1 | 43 | 250.366 | 4 | ↓ |
