In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 21 | Yes |
Popular Name: 2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-3-hydroxy-chromen-4-one 2-(1-ethyl-3,5-dimethyl-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) | 2.64 | 7.17 | -60.7 | 0 | 5 | -1 | 71 | 283.307 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.64 | 6.37 | -12.12 | 1 | 5 | 0 | 68 | 284.315 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.