In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 19 | Yes |
Popular Name: N-(1,3,4-thiadiazol-2-yl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide N-(1,3,4-thiadiazol-2-yl)-1-(2,2…
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) | 1.56 | 2.96 | -18.65 | 1 | 5 | 0 | 58 | 294.302 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.56 | 5.07 | -57.23 | 2 | 5 | 1 | 59 | 295.31 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.