| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | Yes |
Popular Name: N-[3-(4-methylpiperazin-1-yl)propyl]-1-prop-2-ynyl-piperidin-4-amine N-[3-(4-methylpiperazin-1-yl)pro…
| 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) | 0.87 | 4.91 | -89.23 | 3 | 4 | 2 | 28 | 280.46 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.87 | 4.8 | -109.31 | 3 | 4 | 2 | 28 | 280.46 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.87 | 2.53 | -41.97 | 2 | 4 | 1 | 26 | 279.452 | 6 | ↓ |
