| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2011 | 20 | No |
Popular Name: (1E)-4-methyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidothioic (1E)-4-methyl-N-[3-(trifluoromet…
None
| 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) | -1.19 | 8.96 | -51.71 | 2 | 3 | 1 | 19 | 304.361 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 8.59 | -51.11 | 1 | 3 | 0 | 20 | 303.353 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
