In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 29 | 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) | 5.38 | 9.91 | -42.82 | 1 | 5 | -1 | 78 | 404.515 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.92 | 11.03 | -11.92 | 2 | 5 | 0 | 75 | 405.523 | 4 | ↓ |