In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2004 | 36 | 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) | 5.52 | 11.64 | -67.45 | 0 | 7 | -1 | 92 | 499.568 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.94 | -0.17 | -26.29 | 0 | 7 | 0 | 85 | 500.576 | 6 | ↓ |