| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 24 | Yes |
Popular Name: 6-piperazin-1-yl-4-(2-pyrrolidin-1-ylethyl)-1,4-benzoxazin-3-one 6-piperazin-1-yl-4-(2-pyrrolidin…
| 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) | 1.04 | 5.65 | -97.02 | 3 | 6 | 2 | 54 | 332.448 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.04 | 3.13 | -53.53 | 2 | 6 | 1 | 53 | 331.44 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.04 | 4.25 | -37.29 | 2 | 6 | 1 | 49 | 331.44 | 4 | ↓ |
