In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2009 | 37 | 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) | 6.95 | 16.02 | -43.72 | 0 | 5 | -1 | 70 | 496.627 | 10 | ↓ |
Lo Low (pH 4.5-6) | 6.95 | 14.89 | -18.45 | 1 | 5 | 0 | 67 | 497.635 | 10 | ↓ |