In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 21 | Yes |
Popular Name: N-methyl-N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-triazole-4-carboxamide N-methyl-N-[[2-(trifluoromethoxy…
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) | 1.78 | 5.2 | -9.8 | 1 | 6 | 0 | 71 | 300.24 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 5.18 | -40.89 | 0 | 6 | -1 | 69 | 299.232 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.