| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 17 | No |
Popular Name: N-[(2S)-2-(1,4-thiazepan-4-yl)propyl]cyclohexanamine N-[(2S)-2-(1,4-thiazepan-4-yl)pr…
| 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) | 3.02 | 7.82 | -38.9 | 2 | 2 | 1 | 20 | 257.467 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.02 | 8.9 | -121.03 | 3 | 2 | 2 | 21 | 258.475 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Cyclohexyl-[2-(1,4-thiazepan-4-yl)ethyl]amine](http://zinc12.docking.org/img/rings/47118.gif)