In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 18 | Yes |
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) | -0.59 | -0.4 | -42.13 | 4 | 5 | 1 | 85 | 271.362 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.59 | -0.79 | -11.33 | 3 | 5 | 0 | 84 | 270.354 | 3 | ↓ |