| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2011 | 21 | No |
Popular Name: N-[(4-ethyl-5-sulfanyl-1,2,4-triazol-3-yl)methyl]-1H-benzimidazole-5-carboxamide N-[(4-ethyl-5-sulfanyl-1,2,4-tri…
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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) | -0.01 | 6.12 | -20.75 | 3 | 7 | 0 | 91 | 302.363 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.71 | 5.88 | -49.92 | 2 | 7 | -1 | 88 | 301.355 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.01 | 6.61 | -51.29 | 4 | 7 | 1 | 93 | 303.371 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-[(5-thioxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]-1H-benzimidazole-5-carboxamide](http://zinc12.docking.org/img/rings/305483.gif)