| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 25 | Yes |
Popular Name: N-(2-isopropoxyphenyl)-4-(2,2,2-trifluoroethyl)-1,4-diazepane-1-carboxamide N-(2-isopropoxyphenyl)-4-(2,2,2-…
| 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) | 3.53 | 7.72 | -8.22 | 1 | 5 | 0 | 45 | 359.392 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.53 | 9.06 | -48.99 | 2 | 5 | 1 | 46 | 360.4 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
