In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 17 | 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 | 7.84 | -33.6 | 2 | 2 | 1 | 20 | 231.363 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 6.97 | -28.52 | 2 | 2 | 1 | 16 | 231.363 | 2 | ↓ |