In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2009 | 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) | 5.26 | 13.78 | -40.77 | 0 | 4 | -1 | 60 | 430.911 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.26 | 12.65 | -15.98 | 1 | 4 | 0 | 58 | 431.919 | 5 | ↓ |