In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2009 | 17 | 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) | 4.14 | 7.9 | -45.07 | 1 | 3 | -1 | 60 | 241.351 | 12 | ↓ |
Lo Low (pH 4.5-6) | 4.14 | 5.92 | -6.77 | 2 | 3 | 0 | 58 | 242.359 | 12 | ↓ |