| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2010 | 23 | No |
Popular Name: N-(1,1-dimethylbutyl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide N-(1,1-dimethylbutyl)-2-[3-(m-to…
| 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) | 4.07 | 9.3 | -56.4 | 1 | 5 | -1 | 60 | 331.465 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | 9.21 | -15.51 | 2 | 5 | 0 | 63 | 332.473 | 6 | ↓ |
