In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 20 | Yes |
Popular Name: 2-[[4-[(1R,2S,4R)-2,4-dimethylcyclohexyl]-5-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetic 2-[[4-[(1R,2S,4R)-2,4-dimethylcy…
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) | 2.44 | 9.25 | -50.53 | 0 | 5 | -1 | 71 | 296.416 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.