In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 39 | 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) | 6.03 | 17.15 | -40.93 | 3 | 6 | 1 | 61 | 517.701 | 8 | ↓ |
Hi High (pH 8-9.5) | 6.03 | 14.88 | -9.56 | 2 | 6 | 0 | 60 | 516.693 | 8 | ↓ |