In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 14 | 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) | -1.56 | -0.42 | -40.99 | 5 | 4 | 1 | 80 | 195.242 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.56 | -0.75 | -10.48 | 4 | 4 | 0 | 78 | 194.234 | 4 | ↓ |