In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 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) | 0.17 | 1.92 | -50.85 | 2 | 5 | 1 | 57 | 248.372 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.17 | 0.51 | -8.45 | 1 | 5 | 0 | 53 | 247.364 | 2 | ↓ |