In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 20 | 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) | 2.36 | 5.63 | -24.9 | 2 | 4 | 1 | 47 | 273.356 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 5.18 | -7.85 | 1 | 4 | 0 | 46 | 272.348 | 3 | ↓ |