In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 24 | 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) | 1.09 | -3.35 | -14.84 | 2 | 8 | 0 | 102 | 338.408 | 9 | ↓ |
Mid Mid (pH 6-8) | -3.40 | -3.07 | -52.41 | 3 | 8 | 1 | 104 | 339.416 | 9 | ↓ |