In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2009 | 18 | 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) | 2.63 | 8.13 | -45.27 | 2 | 3 | 1 | 33 | 244.362 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 8.65 | -91.39 | 3 | 3 | 2 | 34 | 245.37 | 5 | ↓ |