In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 15 | 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) | 0.25 | -2.79 | -18.31 | 3 | 7 | 0 | 115 | 250.305 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.25 | -2.3 | -50.73 | 2 | 7 | -1 | 113 | 249.297 | 4 | ↓ |