In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2009 | 28 | 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) | 3.78 | 8.46 | -9.78 | 1 | 6 | 0 | 71 | 417.918 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.12 | 9.51 | -34.4 | 2 | 6 | 1 | 70 | 418.926 | 6 | ↓ |