| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 4th, 2011 | 22 | No |
Popular Name: 3-(3,5-dimethylphenoxy)-N-[(4-methyl-5-sulfanyl-1,2,4-triazol-3-yl)methyl]propanamide 3-(3,5-dimethylphenoxy)-N-[(4-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) | 1.21 | 7.22 | -15.69 | 2 | 6 | 0 | 72 | 320.418 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 7.01 | -44.38 | 1 | 6 | -1 | 69 | 319.41 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-phenoxy-N-[(5-thioxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]propionamide](http://zinc12.docking.org/img/rings/305839.gif)