| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2011 | 17 | No |
Popular Name: (1E)-N-(3-chlorophenyl)-4-methyl-piperazine-1-carboximidothioic (1E)-N-(3-chlorophenyl)-4-methyl…
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) | -1.40 | 8.47 | -50.2 | 2 | 3 | 1 | 19 | 270.809 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.82 | 8.1 | -50.69 | 1 | 3 | 0 | 20 | 269.801 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
