| 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-propyl-pentanediamide N'-[2-(4-cyclopropyl-5-sulfanyl-…
| 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) | 0.23 | 5.69 | -30.96 | 3 | 7 | 0 | 92 | 339.465 | 10 | ↓ |
| Mid Mid (pH 6-8) | 0.96 | 5.64 | -63.64 | 2 | 7 | -1 | 89 | 338.457 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
