In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 28 | 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) | 6.89 | 13.87 | -8.88 | 0 | 2 | 0 | 22 | 363.46 | 2 | ↓ |
Lo Low (pH 4.5-6) | 6.89 | 14.13 | -26.41 | 1 | 2 | 1 | 23 | 364.468 | 2 | ↓ |