| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 28 | No |
Popular Name: N-benzyl-3-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-propyl-propanamide N-benzyl-3-[3-(m-tolyl)-5-thioxo…
| 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) | 3.89 | 14.04 | -13.22 | 1 | 5 | 0 | 54 | 394.544 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.61 | 13.89 | -49.94 | 0 | 5 | -1 | 51 | 393.536 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
