| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 5th, 2011 | 23 | No |
Popular Name: N'-[2-(4-cyclopropyl-5-sulfanyl-1,2,4-triazol-3-yl)ethyl]-N-isopropyl-pentanediamide N'-[2-(4-cyclopropyl-5-sulfanyl-…
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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) | 0.03 | 5.73 | -30.84 | 3 | 7 | 0 | 92 | 339.465 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.76 | 5.68 | -63.72 | 2 | 7 | -1 | 89 | 338.457 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
