In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 32 | 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) | 5.79 | 9.89 | -40.28 | 1 | 6 | -1 | 87 | 452.531 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.33 | 11.01 | -14.05 | 2 | 6 | 0 | 84 | 453.539 | 8 | ↓ |