UCSF

ZINC01589884

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 13 Yes

Popular Name: 2-CYCLOHEXYLCYCLOHEXANONE 2-CYCLOHEXYLCYCLOHEXANONE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1444-65-1 , 90-42-6

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) 3.55 7.69 -4.12 0 1 0 17 180.291 1 ↓

Vendor Notes

Note Type Comments Provided By
BP 269 TCI
Melting_Point 56-59? Alfa-Aesar
Melting_Point 56-59° Alfa-Aesar

Activity (Go SEA)

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