In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 25 | Yes |
Popular Name: (2S)-N-[2-(1-ethylpropyl)pyrazol-3-yl]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxamide (2S)-N-[2-(1-ethylpropyl)pyrazol…
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) | 2.54 | 7.78 | -15.25 | 2 | 7 | 0 | 85 | 342.399 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 5.02 | -56.45 | 1 | 7 | -1 | 92 | 341.391 | 5 | ↓ |