In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 31 | 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) | 4.40 | 8.01 | -9 | 3 | 5 | 0 | 81 | 462.884 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.40 | 8.48 | -39.91 | 4 | 5 | 1 | 82 | 463.892 | 5 | ↓ |