In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 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) | 1.71 | 3.88 | -39.28 | 3 | 3 | 1 | 40 | 229.388 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.71 | 4.91 | -26.62 | 3 | 3 | 1 | 40 | 229.388 | 6 | ↓ |