In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 20 | Yes |
Popular Name: 4-allyl-6-[(1S)-1-amino-2,2,2-trifluoro-ethyl]-1,4-benzoxazin-3-one 4-allyl-6-[(1S)-1-amino-2,2,2-tr…
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) | 0.27 | 3.65 | -8.52 | 2 | 4 | 0 | 56 | 286.253 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.27 | 3.98 | -60.76 | 3 | 4 | 1 | 57 | 287.261 | 4 | ↓ |