In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 18 | 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) | 2.45 | 6.45 | -15.22 | 3 | 3 | 0 | 51 | 257.362 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.45 | 6.8 | -46.03 | 4 | 3 | 1 | 52 | 258.37 | 5 | ↓ |