In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 20 | Yes |
Popular Name: 8-amino-4-[2-(1-piperidyl)ethyl]-1,4-benzoxazin-3-one 8-amino-4-[2-(1-piperidyl)ethyl]…
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) | 1.60 | 5.61 | -37.38 | 3 | 5 | 1 | 60 | 276.36 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.60 | 3.33 | -7.97 | 2 | 5 | 0 | 59 | 275.352 | 3 | ↓ |