In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2010 | 18 | 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) | 2.87 | 9.59 | -42.68 | 1 | 5 | 1 | 53 | 270.74 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 7.35 | -5.86 | 0 | 5 | 0 | 52 | 269.732 | 3 | ↓ |