In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2009 | 25 | 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) | 1.43 | 4.32 | -11.86 | 2 | 5 | 0 | 57 | 339.439 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 6.5 | -42.79 | 3 | 5 | 1 | 59 | 340.447 | 3 | ↓ |