In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 21 | Yes |
Popular Name: 6-[(2,4-dihydroxyphenyl)methylamino]-4H-1,4-benzoxazin-3-one 6-[(2,4-dihydroxyphenyl)methylam…
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) | 1.66 | -1.43 | -15.04 | 4 | 6 | 0 | 91 | 286.287 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.66 | -0.65 | -43.79 | 3 | 6 | -1 | 94 | 285.279 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.