In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2010 | 20 | 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) | 4.22 | 10.5 | -40.81 | 1 | 2 | 1 | 14 | 288.798 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.22 | 8.06 | -3.24 | 0 | 2 | 0 | 12 | 287.79 | 4 | ↓ |