In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 26th, 2011 | 17 | Yes |
Popular Name: 5-acetamido-N-(4H-1,2,4-triazol-3-yl)thiophene-2-carboxamide 5-acetamido-N-(4H-1,2,4-triazol-…
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) | -0.16 | 4.21 | -19.28 | 3 | 7 | 0 | 100 | 251.271 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.16 | 4.02 | -54.44 | 2 | 7 | -1 | 98 | 250.263 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.