In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 22 | 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) | -4.09 | -6.14 | -236.56 | 4 | 12 | -3 | 212 | 345.173 | 7 | ↓ |
Mid Mid (pH 6-8) | -4.09 | -7.3 | -119.5 | 5 | 12 | -2 | 209 | 346.181 | 7 | ↓ |