| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 30 | Yes |
Popular Name: [1-(4-anilinopyrimidin-2-yl)-4-piperidyl]-[4-(2-hydroxyethyl)piperazin-1-yl]methanone [1-(4-anilinopyrimidin-2-yl)-4-p…
| 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) | 2.47 | 8.07 | -15.18 | 2 | 8 | 0 | 85 | 410.522 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.47 | 10.66 | -90.88 | 4 | 8 | 2 | 87 | 412.538 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.47 | 8.37 | -42.85 | 3 | 8 | 1 | 86 | 411.53 | 6 | ↓ |
