| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2010 | 14 | Yes |
Popular Name: (2S)-2,3-dimethyl-2-(4-methylpiperazin-1-yl)butan-1-amine (2S)-2,3-dimethyl-2-(4-methylpip…
| 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) | 0.59 | 2.71 | -89.88 | 4 | 3 | 2 | 35 | 201.358 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.59 | 2.31 | -106.26 | 4 | 3 | 2 | 35 | 201.358 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.59 | 0.36 | -42.11 | 3 | 3 | 1 | 34 | 200.35 | 3 | ↓ |
