| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 18 | Yes |
Popular Name: (1S)-1-(3-methoxyphenyl)-2-(4-methylpiperazin-1-yl)ethanamine (1S)-1-(3-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) | -0.62 | 3.56 | -101.28 | 4 | 4 | 2 | 45 | 251.374 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.62 | 0.82 | -4.44 | 2 | 4 | 0 | 42 | 249.358 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.62 | 2.99 | -31.62 | 3 | 4 | 1 | 43 | 250.366 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.62 | 1.09 | -51.7 | 3 | 4 | 1 | 43 | 250.366 | 4 | ↓ |
