In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2006 | 43 | 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) | 6.26 | 1.12 | -55.92 | 2 | 7 | 1 | 80 | 583.749 | 11 | ↓ |
Mid Mid (pH 6-8) | 5.67 | 1.03 | -67.68 | 1 | 7 | 1 | 77 | 583.749 | 11 | ↓ |