In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2009 | 30 | No |
Popular Name: 2-[(2S,3'R,6'R)-3'-dihydroxy-6'-methyl-4'-trioxo-spiro[BLAH-2,2'-tetrahydropyran]yl]acetic 2-[(2S,3'R,6'R)-3'-dihydroxy-6'-…
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) | -0.63 | 4.23 | -124.22 | 1 | 10 | -2 | 166 | 416.338 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.63 | 3.7 | -110.02 | 1 | 10 | -2 | 166 | 416.338 | 2 | ↓ |