| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 21 | Yes |
Popular Name: (2S)-2-cyclopropyl-3-(5,6-dimethylbenzimidazol-1-yl)-2-(ethylamino)propanenitrile (2S)-2-cyclopropyl-3-(5,6-dimeth…
| 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) | 3.17 | 8.87 | -11.32 | 1 | 4 | 0 | 54 | 282.391 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.17 | 9.35 | -31.25 | 2 | 4 | 1 | 55 | 283.399 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.17 | 10.22 | -104.33 | 3 | 4 | 2 | 59 | 284.407 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
