In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 35 | Yes |
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) | 1.38 | -3.72 | -28.35 | 6 | 10 | 0 | 166 | 482.441 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.38 | -2.71 | -69.76 | 5 | 10 | -1 | 169 | 481.433 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.