| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2008 | 16 | Yes |
Popular Name: 4-(2,5-Diaza-bicyclo[2.2.1]hept-2-ylmethyl)-benzonitrile 4-(2,5-Diaza-bicyclo[2.2.1]hept-…
Find On: PubMed — Wikipedia — Google
CAS Number: 845866-73-1
(1S,4S)-4-(2,5-Diaza-bicyclo[2.2.1]hept-2-ylmethyl)-benzonitrile
| 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) | 1.25 | 3.74 | -49.33 | 2 | 3 | 1 | 44 | 214.292 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.