In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 20 | Yes |
Popular Name: N-[4-(allylcarbamoyl)phenyl]-1H-triazole-4-carboxamide N-[4-(allylcarbamoyl)phenyl]-1H-…
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) | 0.75 | 1.2 | -11.05 | 3 | 7 | 0 | 100 | 271.28 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.75 | 1.1 | -36.84 | 2 | 7 | -1 | 98 | 270.272 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.