In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2008 | 37 | 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) | 6.10 | 11.93 | -13.41 | 3 | 8 | 0 | 116 | 499.567 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.10 | 12.89 | -59.38 | 2 | 8 | -1 | 119 | 498.559 | 6 | ↓ |