In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 15 | No |
Popular Name: 1-[2-(3-thienyl)ethyl]-1,2,4-triazole-3-carbothioamide 1-[2-(3-thienyl)ethyl]-1,2,4-tri…
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) | 0.76 | 5.85 | -15.76 | 2 | 4 | 0 | 57 | 238.341 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.