In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2011 | 18 | No |
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) | 3.56 | 10.13 | -128.93 | 0 | 4 | -2 | 80 | 254.326 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 8.02 | -48.62 | 1 | 4 | -1 | 77 | 255.334 | 7 | ↓ |