In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 1st, 2007 | 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) | 4.84 | 13.78 | -75.44 | 1 | 7 | 0 | 83 | 500.595 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.26 | 1.98 | -54.2 | 1 | 7 | 1 | 77 | 501.603 | 10 | ↓ |