UCSF

ZINC02569895

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 18 Yes

Popular Name: 4-(trans-4-Butylcyclohexyl)-benzonitrile 4-(trans-4-Butylcyclohexyl)-benz…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 61204-00-0 , [61204-00-0]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 5.58 11.49 -4.09 0 1 0 24 241.378 4 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 40-43? Alfa-Aesar
Melting_Point 40-43° Alfa-Aesar
Purity 97% Fluorochem

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )