In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 1st, 2006 | 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) | 4.82 | 11.03 | -43.49 | 0 | 2 | -1 | 40 | 239.379 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.82 | 9.04 | -4.96 | 1 | 2 | 0 | 37 | 240.387 | 9 | ↓ |