In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 19 | 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) | 0.96 | 2.71 | -46.58 | 5 | 5 | 1 | 83 | 264.349 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.96 | 0.41 | -11.15 | 4 | 5 | 0 | 82 | 263.341 | 5 | ↓ |