| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 22nd, 2007 | 26 | Yes |
Popular Name: 8-butyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)-2,4,8-triazabicyclo[4.4.0]deca-1,3,5-triene 8-butyl-3-(4-pyrimidin-2-ylpiper…
| 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) | 2.78 | 13.88 | -46.04 | 1 | 7 | 1 | 62 | 354.482 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 11.61 | -8.81 | 0 | 7 | 0 | 61 | 353.474 | 5 | ↓ |
