In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 24 | Yes |
Popular Name: 1-(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)-3-(2,4,5-trimethylpyrazol-3-yl)urea 1-(6-chloro-3-oxo-4H-1,4-benzoxa…
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) | 1.94 | 3.11 | -14.43 | 3 | 8 | 0 | 97 | 349.778 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.94 | 3.25 | -34.7 | 4 | 8 | 1 | 99 | 350.786 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.