In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2008 | 22 | No |
Popular Name: (2R,3S)-2,3-dihydroxy-2,3-diisopropoxy-tetralin-1,4-dione (2R,3S)-2,3-dihydroxy-2,3-diisop…
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) | 1.07 | 4.38 | -12.09 | 2 | 6 | 0 | 93 | 308.33 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.07 | 5.05 | -50.03 | 1 | 6 | -1 | 96 | 307.322 | 4 | ↓ |