UCSF

ZINC05458209

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2006 13 Yes

Popular Name: Ethyl 2-(trans-4-aminocyclohexyl)acetate hydrochloride Ethyl 2-(trans-4-aminocyclohexyl…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 343775-23-5 , 76308-26-4 , 76308-28-6 , [76308-26-4]

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) 0.87 4.2 -45.68 3 3 1 54 186.275 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID US5977110; WO1997011070A1 IBM Patent Data

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