In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 9th, 2006 | 23 | No |
Popular Name: 3-(3,7-dimethylocta-2,6-dienyl)-2-hydroxy-naphthalene-1,4-dione 3-(3,7-dimethylocta-2,6-dienyl)-…
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) | 5.01 | 11.18 | -42.14 | 0 | 3 | -1 | 57 | 309.385 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.00 | 2.03 | -23.83 | 1 | 3 | 0 | 54 | 310.393 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.13 | 1.76 | -9.53 | 0 | 3 | 0 | 51 | 310.393 | 5 | ↓ |