In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 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) | 0.82 | 1.37 | -47.37 | 4 | 3 | 1 | 57 | 196.27 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.82 | 1 | -6.65 | 3 | 3 | 0 | 55 | 195.262 | 5 | ↓ |