In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 21 | Yes |
Popular Name: 2-[4-(1-amino-1-methyl-ethyl)triazol-1-yl]-N-(3-fluoro-4-methyl-phenyl)acetamide 2-[4-(1-amino-1-methyl-ethyl)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) | 1.63 | 3.15 | -60.31 | 4 | 6 | 1 | 87 | 292.338 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.63 | 2.9 | -18.89 | 3 | 6 | 0 | 86 | 291.33 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.