In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2010 | 18 | 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) | 4.43 | 10.07 | -52.49 | 0 | 3 | -1 | 43 | 246.33 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.43 | 9.89 | -35.25 | 1 | 3 | 0 | 45 | 247.338 | 2 | ↓ |