| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 24 | Yes |
Popular Name: 1-({6-[(1-cyanocyclohexyl)amino]-hexyl}amino)cyclohexanecarbonitrile 1-({6-[(1-cyanocyclohexyl)amino]…
Find On: PubMed — Wikipedia — Google
CAS Number: 22411-41-2
None
| 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) | 4.96 | 8.35 | -53.29 | 3 | 4 | 1 | 76 | 331.528 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.96 | 7.09 | -8.59 | 2 | 4 | 0 | 72 | 330.52 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.96 | 9.63 | -107.81 | 4 | 4 | 2 | 81 | 332.536 | 9 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
