In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 32 | 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) | 1.37 | 4.06 | -119.89 | 8 | 10 | 2 | 158 | 450.584 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.37 | 5.42 | -210.46 | 9 | 10 | 3 | 163 | 451.592 | 10 | ↓ |