| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 4th, 2011 | 22 | No |
Popular Name: N-[3-[1-[[methyl(propyl)amino]methyl]-5-thioxo-1,2,4-triazol-4-yl]phenyl]acetamide N-[3-[1-[[methyl(propyl)amino]me…
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| 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) | 1.09 | 11.16 | -44.96 | 2 | 6 | 1 | 56 | 320.442 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.09 | 8.69 | -16.51 | 1 | 6 | 0 | 55 | 319.434 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
