In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 19 | 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) | 2.27 | 3.79 | -101.94 | 0 | 6 | -2 | 101 | 316.747 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 3.69 | -53.79 | 1 | 6 | -1 | 99 | 317.755 | 4 | ↓ |