| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: [2-(4-isopropylpiperazin-1-yl)-6-methyl-3-pyridyl]methanamine [2-(4-isopropylpiperazin-1-yl)-6…
| 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) | 0.90 | 6.48 | -184.08 | 5 | 4 | 3 | 49 | 251.398 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.90 | 6.03 | -101.84 | 4 | 4 | 2 | 48 | 250.39 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.90 | 3.88 | -47.2 | 3 | 4 | 1 | 47 | 249.382 | 3 | ↓ |
