In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 18 | 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) | -0.88 | -5.87 | -41.46 | 2 | 8 | -1 | 135 | 268.23 | 2 | ↓ |
Lo Low (pH 4.5-6) | -1.34 | -3.19 | -13.96 | 3 | 8 | 0 | 132 | 269.238 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.