| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2010 | 20 | Yes |
Popular Name: 2-(propylamino)-1-[4-(2-pyridylmethyl)piperazin-1-yl]ethanone 2-(propylamino)-1-[4-(2-pyridylm…
| 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) | 0.10 | 4.05 | -44.7 | 2 | 5 | 1 | 53 | 277.392 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.10 | 2.7 | -9.72 | 1 | 5 | 0 | 48 | 276.384 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.10 | 6.27 | -101.26 | 3 | 5 | 2 | 54 | 278.4 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.10 | 4.78 | -83.96 | 3 | 5 | 2 | 54 | 278.4 | 6 | ↓ |
