| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 20 | Yes |
Popular Name: 3-[(5-amino-4-isopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-fluoro-benzonitrile 3-[(5-amino-4-isopropyl-1,2,4-tr…
| 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) | 2.36 | 9.76 | -13.66 | 2 | 5 | 0 | 81 | 291.355 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
