UCSF

ZINC02166916

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 11 Yes

Popular Name: 2-(tert-Butyl)cyclohexanone 2-(tert-Butyl)cyclohexanone

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CAS Numbers: 1728-46-7 , [1728-46-7]

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) 2.97 2.15 -3.63 0 1 0 17 154.253 1 ↓

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