| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2011 | 20 | Yes |
Popular Name: 6-[[(3S)-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methylamino]pyridine-2-carbonitrile 6-[[(3S)-1-(2,2,2-trifluoroethyl…
| 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) | 2.18 | 4.53 | -10.49 | 1 | 4 | 0 | 52 | 284.285 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 6.86 | -50.81 | 2 | 4 | 1 | 53 | 285.293 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
