In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 2008 | 17 | 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) | 2.16 | 5.09 | -38.77 | 3 | 4 | 1 | 69 | 232.307 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.98 | 3.68 | -27.98 | 2 | 4 | 0 | 76 | 231.299 | 4 | ↓ |