In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 31st, 2005 | 21 | 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) | 5.29 | 10.82 | -7.96 | 1 | 2 | 0 | 29 | 285.431 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.47 | 9.45 | -35.79 | 2 | 2 | 1 | 34 | 286.439 | 4 | ↓ |