In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 31 | No |
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) | 5.99 | 8.39 | -52.81 | 2 | 5 | -1 | 89 | 485.398 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.99 | 7.62 | -11.01 | 3 | 5 | 0 | 87 | 486.406 | 5 | ↓ |