In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 14 | 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) | 1.33 | 4.82 | -34.14 | 2 | 2 | 1 | 25 | 212.338 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.33 | 2.5 | -4.1 | 1 | 2 | 0 | 23 | 211.33 | 6 | ↓ |