| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 21 | Yes |
Popular Name: [2-(ethylamino)-4-pyridyl]-[4-[(1R)-1-methylpropyl]piperazin-1-yl]methanone [2-(ethylamino)-4-pyridyl]-[4-[(…
| 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) | 1.29 | 4.85 | -8.03 | 1 | 5 | 0 | 48 | 290.411 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.29 | 6.68 | -42.68 | 2 | 5 | 1 | 50 | 291.419 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
