In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 13 | 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) | 0.45 | 2.21 | -35.8 | 3 | 4 | 0 | 77 | 181.191 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.45 | 1.09 | -44.75 | 2 | 4 | -1 | 72 | 180.183 | 3 | ↓ |