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) | 0.34 | 2.04 | -12.61 | 2 | 8 | 0 | 125 | 301.258 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.34 | 2.59 | -43.39 | 1 | 8 | -1 | 128 | 300.25 | 5 | ↓ |