In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2010 | 19 | 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) | 1.61 | 8.38 | -15.89 | 0 | 5 | 0 | 57 | 257.341 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 10.22 | -54.96 | 1 | 5 | 1 | 58 | 258.349 | 4 | ↓ |