In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 20 | Yes |
Popular Name: 2-(1-ethyl-5-methyl-pyrazol-4-yl)-3-hydroxy-chromen-4-one 2-(1-ethyl-5-methyl-pyrazol-4-yl…
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) | 2.42 | 6.56 | -61.27 | 0 | 5 | -1 | 71 | 269.28 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 5.77 | -11.98 | 1 | 5 | 0 | 68 | 270.288 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.