| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 19 | Yes |
Popular Name: (2R)-2-amino-2-cyclopropyl-3-(5,6-dimethylbenzimidazol-1-yl)propanenitrile (2R)-2-amino-2-cyclopropyl-3-(5,…
| 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) | 2.42 | 7.2 | -13.44 | 2 | 4 | 0 | 68 | 254.337 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 7.68 | -34.8 | 3 | 4 | 1 | 69 | 255.345 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.42 | 7.98 | -109.72 | 4 | 4 | 2 | 71 | 256.353 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
