In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 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) | 2.98 | 4.65 | -19.89 | 2 | 4 | 0 | 66 | 269.3 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 5.45 | -54.34 | 1 | 4 | -1 | 69 | 268.292 | 3 | ↓ |