In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2006 | 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) | 5.49 | 0.95 | -56.3 | 2 | 6 | 1 | 71 | 564.5 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.91 | 0.86 | -68.62 | 1 | 6 | 1 | 68 | 564.5 | 10 | ↓ |