In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2007 | 27 | 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) | 3.46 | 8.08 | -58.69 | 0 | 5 | -1 | 70 | 447.33 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.88 | -3.11 | -23.92 | 0 | 5 | 0 | 63 | 448.338 | 5 | ↓ |