In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 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) | 4.15 | 7.65 | -30.76 | 2 | 2 | 1 | 25 | 248.39 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.15 | 7.51 | -3.62 | 1 | 2 | 0 | 23 | 247.382 | 4 | ↓ |