In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 13th, 2009 | 20 | 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) | 3.54 | 8.36 | -38.81 | 2 | 2 | 1 | 25 | 290.814 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.54 | 6.83 | -3.65 | 1 | 2 | 0 | 23 | 289.806 | 5 | ↓ |