In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2010 | 34 | 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) | 0.88 | 1.94 | -249.69 | 4 | 15 | -3 | 241 | 538.392 | 12 | ↓ |
Mid Mid (pH 6-8) | 0.88 | 0.78 | -129.63 | 5 | 15 | -2 | 238 | 539.4 | 12 | ↓ |