| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 15 | Yes |
Popular Name: (2R)-2-amino-2-cyclopropyl-3-(3,5-dimethyl-1,2,4-triazol-1-yl)propanenitrile (2R)-2-amino-2-cyclopropyl-3-(3,…
| 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) | -0.24 | 3.47 | -16.57 | 2 | 5 | 0 | 81 | 205.265 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.24 | 3.76 | -59.81 | 3 | 5 | 1 | 82 | 206.273 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
