In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2010 | 24 | 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) | 2.88 | 9.79 | -12.88 | 1 | 5 | 0 | 60 | 319.364 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.34 | 7.92 | -44.03 | 0 | 5 | -1 | 63 | 318.356 | 4 | ↓ |