| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 13 | Yes |
Popular Name: (2S)-2-amino-2-cyclopropyl-3-(1,2,4-triazol-1-yl)propanenitrile (2S)-2-amino-2-cyclopropyl-3-(1,…
| 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) | -0.42 | 4.76 | -11.23 | 2 | 5 | 0 | 81 | 177.211 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.42 | 5.03 | -46.63 | 3 | 5 | 1 | 82 | 178.219 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
