In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 16 | 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) | -1.39 | -0.71 | -57.12 | 3 | 6 | 1 | 85 | 250.344 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.39 | -1.09 | -15.67 | 2 | 6 | 0 | 84 | 249.336 | 4 | ↓ |