In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 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) | -0.08 | 3.98 | -81.57 | 1 | 6 | 0 | 82 | 278.374 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.08 | 1.56 | -52.98 | 0 | 6 | -1 | 81 | 277.366 | 6 | ↓ |