In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2010 | 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) | 1.06 | 6.59 | -40.79 | 2 | 5 | 1 | 54 | 251.354 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.06 | 4.39 | -8.06 | 1 | 5 | 0 | 52 | 250.346 | 6 | ↓ |