| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 30th, 2009 | 31 | Yes |
Popular Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[3-(pyrimidin-2-ylamino)phenyl]methanone [4-(1,3-benzodioxol-5-ylmethyl)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) | 2.23 | 8.78 | -15.61 | 1 | 8 | 0 | 80 | 417.469 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 11.04 | -54.03 | 2 | 8 | 1 | 81 | 418.477 | 5 | ↓ |
