| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 24 | Yes |
Popular Name: N-methyl-2-[2-[[[(3S)-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]amino]methyl]phenoxy]acetamide N-methyl-2-[2-[[[(3S)-1-(2,2,2-t…
| 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) | 1.69 | 4.35 | -44.25 | 3 | 5 | 1 | 58 | 346.373 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.69 | 3.14 | -12.33 | 2 | 5 | 0 | 54 | 345.365 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
