| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 20 | Yes |
Popular Name: (2S)-3-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-2-methyl-propan-1-amine (2S)-3-[4-[(3-methoxyphenyl)meth…
| 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) | 1.22 | 4.64 | -105.59 | 4 | 4 | 2 | 45 | 279.428 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.22 | 4.9 | -92.93 | 4 | 4 | 2 | 45 | 279.428 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.22 | 2.66 | -45.18 | 3 | 4 | 1 | 43 | 278.42 | 6 | ↓ |
