In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2010 | 16 | 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) | 2.66 | 6.34 | -5.48 | 3 | 3 | 0 | 55 | 213.284 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 6.47 | -27.69 | 4 | 3 | 1 | 56 | 214.292 | 2 | ↓ |