In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 19th, 2011 | 22 | 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) | 4.87 | 9.83 | -8.25 | 1 | 3 | 0 | 32 | 300.446 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.87 | 10.47 | -33.39 | 2 | 3 | 1 | 34 | 301.454 | 4 | ↓ |