In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 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) | 3.48 | 10.37 | -13.05 | 0 | 3 | 0 | 42 | 261.328 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.48 | 10.78 | -34.27 | 1 | 3 | 1 | 43 | 262.336 | 3 | ↓ |