In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 21 | Yes |
Popular Name: (7S,9S)-7,13,15-trihydroxy-9-methyl-10-oxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-11-one (7S,9S)-7,13,15-trihydroxy-9-met…
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) | 2.96 | 3.34 | -6.85 | 3 | 5 | 0 | 87 | 294.347 | 0 | ↓ |
Hi High (pH 8-9.5) | 2.96 | 4.34 | -50.34 | 2 | 5 | -1 | 90 | 293.339 | 0 | ↓ |