In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 19 | 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) | 1.88 | 9.07 | -58.3 | 1 | 4 | 1 | 61 | 258.345 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 6.93 | -11.05 | 0 | 4 | 0 | 60 | 257.337 | 8 | ↓ |