In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 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) | 1.09 | 6.76 | -13.92 | 1 | 5 | 0 | 56 | 273.336 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 7.25 | -43.53 | 2 | 5 | 1 | 57 | 274.344 | 7 | ↓ |