In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 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) | 2.54 | 8.34 | -51.7 | 2 | 3 | 1 | 34 | 244.362 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 8.77 | -92.89 | 3 | 3 | 2 | 36 | 245.37 | 3 | ↓ |