| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 4th, 2011 | 23 | Yes |
Popular Name: (2R)-2-methoxy-2-phenyl-1-[4-(2,2,2-trifluoroethyl)-1,4-diazepan-1-yl]ethanone (2R)-2-methoxy-2-phenyl-1-[4-(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) | 2.32 | 7.62 | -11.17 | 0 | 4 | 0 | 33 | 330.35 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.32 | 8.9 | -54 | 1 | 4 | 1 | 34 | 331.358 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
