In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 27th, 2007 | 37 | No |
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) | 5.95 | 13.94 | -44.39 | 0 | 6 | -1 | 79 | 498.599 | 10 | ↓ |
Mid Mid (pH 6-8) | 5.37 | 1.21 | -17.21 | 0 | 6 | 0 | 72 | 499.607 | 10 | ↓ |