In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 24th, 2011 | 20 | 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) | 5.27 | 13.3 | -15.29 | 0 | 2 | 0 | 34 | 274.404 | 10 | ↓ |
Hi High (pH 8-9.5) | 6.02 | 12.21 | -52.39 | 0 | 2 | -1 | 40 | 273.396 | 9 | ↓ |