In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2009 | 33 | 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) | 5.02 | 7.91 | -10.25 | 1 | 5 | 0 | 62 | 474.866 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.02 | 8.68 | -48.07 | 0 | 5 | -1 | 65 | 473.858 | 5 | ↓ |