| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 18 | Yes |
Popular Name: (1S,2S)-2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)cyclopentanecarbonitrile (1S,2S)-2-(1,3,4,5-tetrahydro-2-…
| 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) | 3.30 | 7.99 | -5.33 | 0 | 2 | 0 | 27 | 240.35 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.30 | 10 | -41.37 | 1 | 2 | 1 | 28 | 241.358 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
