| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 19 | Yes |
Popular Name: (2S)-2-amino-N-(2-cyanoethyl)-2-cyclopropyl-N-(2-furylmethyl)propanamide (2S)-2-amino-N-(2-cyanoethyl)-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) | 0.49 | 5.67 | -54.17 | 3 | 5 | 1 | 85 | 262.333 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.49 | 5.42 | -13.63 | 2 | 5 | 0 | 83 | 261.325 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
