In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 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) | 3.73 | 11.28 | -20.39 | 0 | 6 | 0 | 72 | 461.653 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.73 | 11.71 | -45.82 | 1 | 6 | 1 | 74 | 462.661 | 8 | ↓ |