| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 18 | Yes |
Popular Name: 2-[[(1S)-2-cyano-1-phenyl-ethyl]amino]-N-cyclopropyl-acetamide 2-[[(1S)-2-cyano-1-phenyl-ethyl]…
| 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) | 0.21 | 4.43 | -9.32 | 2 | 4 | 0 | 65 | 243.31 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.21 | 5.68 | -48.04 | 3 | 4 | 1 | 69 | 244.318 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
