In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 2009 | 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) | 3.31 | 5.65 | -41.48 | 3 | 4 | 1 | 50 | 325.432 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.31 | 3.38 | -6.39 | 2 | 4 | 0 | 48 | 324.424 | 2 | ↓ |