In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 26th, 2009 | 25 | Yes |
Popular Name: (2S,3R)-2-hexyl-6,8,9-trihydroxy-3-methyl-3,4-dihydro-2H-anthracen-1-one (2S,3R)-2-hexyl-6,8,9-trihydroxy…
None
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) | 5.60 | 7.59 | -10.33 | 3 | 4 | 0 | 78 | 342.435 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.60 | 8.1 | -52.52 | 2 | 4 | -1 | 81 | 341.427 | 5 | ↓ |