UCSF

ZINC36826554

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2009 13 Yes

Popular Name: 2-(decahydroquinolin-1-yl)ethan-1-amine dihydrochloride 2-(decahydroquinolin-1-yl)ethan-…

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CAS Numbers: 1056646-62-8 , 1221723-56-3

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) 1.32 4.98 -113.58 4 2 2 32 184.327 2 ↓
Mid Mid (pH 6-8) 1.32 4.59 -28.39 3 2 1 30 183.319 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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