In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 20 | 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) | 0.77 | 5.54 | -20.78 | 2 | 7 | 0 | 87 | 274.328 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.77 | 6.02 | -40.21 | 3 | 7 | 1 | 88 | 275.336 | 3 | ↓ |