In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 20 | Yes |
Popular Name: N-[3-fluoro-4-[isopropyl(methyl)amino]phenyl]-1H-triazole-4-carboxamide N-[3-fluoro-4-[isopropyl(methyl)…
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 | 3.86 | -9.22 | 2 | 6 | 0 | 74 | 277.303 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 3.74 | -36.96 | 1 | 6 | -1 | 72 | 276.295 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.