In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 2009 | 21 | Yes |
Popular Name: 1-(2,4-dihydroxyphenyl)-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-ethanone 1-(2,4-dihydroxyphenyl)-2-imidaz…
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) | 2.61 | 5.59 | -19.57 | 2 | 5 | 0 | 75 | 300.339 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.61 | 7.41 | -130.42 | 0 | 5 | -2 | 80 | 298.323 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.61 | 6.62 | -57.41 | 1 | 5 | -1 | 78 | 299.331 | 4 | ↓ |