| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2010 | 21 | Yes |
Popular Name: (2S)-3-methyl-2-(4-methylpiperazin-1-yl)-N-[(1R)-1-phenylethyl]butan-1-amine (2S)-3-methyl-2-(4-methylpiperaz…
| 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) | 3.09 | 6.69 | -37.12 | 2 | 3 | 1 | 23 | 290.475 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 8.09 | -30.79 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.09 | 8.55 | -94.07 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
