In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 31 | 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) | -2.88 | 6.39 | -61.97 | 7 | 10 | 0 | 173 | 432.525 | 10 | ↓ |
Mid Mid (pH 6-8) | -2.88 | 6.69 | -104.08 | 8 | 10 | 1 | 174 | 433.533 | 10 | ↓ |