| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 20 | Yes |
Popular Name: 2-methyl-4-[(2S)-2-methyl-3-(4-methylpiperazin-1-yl)propoxy]aniline 2-methyl-4-[(2S)-2-methyl-3-(4-m…
| 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) | 2.52 | 6.05 | -37.52 | 3 | 4 | 1 | 43 | 278.42 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 3.58 | -5.69 | 2 | 4 | 0 | 42 | 277.412 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 5.6 | -37.53 | 3 | 4 | 1 | 43 | 278.42 | 5 | ↓ |
