In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2011 | 25 | 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) | 3.26 | 8.32 | -11.46 | 0 | 4 | 0 | 33 | 338.451 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.26 | 10.52 | -39.15 | 1 | 4 | 1 | 34 | 339.459 | 4 | ↓ |