| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 2nd, 2011 | 21 | No |
Popular Name: N-ethyl-N-[1-[(4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-4-piperidyl]methanesulfonamide N-ethyl-N-[1-[(4-methyl-5-thioxo…
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) | -0.30 | 7.89 | -52.67 | 1 | 7 | 1 | 65 | 334.491 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.30 | 5.5 | -20.9 | 0 | 7 | 0 | 63 | 333.483 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
