In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 25th, 2006 | 16 | 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) | 0.85 | 5.83 | -40.52 | 4 | 5 | 1 | 68 | 224.332 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.85 | 6.34 | -80.1 | 5 | 5 | 2 | 70 | 225.34 | 7 | ↓ |