In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 36 | 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) | 6.90 | 14.23 | -15.46 | 2 | 6 | 0 | 84 | 519.07 | 10 | ↓ |
Hi High (pH 8-9.5) | 7.09 | 12.35 | -43.68 | 1 | 6 | -1 | 90 | 518.062 | 10 | ↓ |