In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 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) | 5.75 | 15.84 | -16.05 | 2 | 8 | 0 | 90 | 489.62 | 10 | ↓ |
Mid Mid (pH 6-8) | 5.92 | 16.39 | -57.22 | 3 | 8 | 1 | 95 | 490.628 | 10 | ↓ |