In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 35 | 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) | 4.09 | 8.33 | -57.12 | 0 | 11 | -1 | 152 | 496.839 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.63 | 10.1 | -20.25 | 1 | 11 | 0 | 149 | 497.847 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.