| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 16 | Yes |
Popular Name: (2S)-2-(cyclopentylamino)-2-(2-fluorophenyl)acetonitrile (2S)-2-(cyclopentylamino)-2-(2-f…
| 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) | 2.98 | 6.63 | -5.43 | 1 | 2 | 0 | 36 | 218.275 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.98 | 7.68 | -46.34 | 2 | 2 | 1 | 40 | 219.283 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
