UCSF

ZINC03257960

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 11 No

Popular Name: 2-Chloro-1-(3-methyl-piperidin-1-yl)-ethanone 2-Chloro-1-(3-methyl-piperidin-1…

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CAS Numbers: 4593-19-5 , [4593-19-5]

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) 1.42 4.93 -8.61 0 2 0 20 175.659 1 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks
MP 91 - 93 Enamine Building Blocks
MP 91...93 Enamine Building Blocks
purity 95 Enamine Building Blocks
Purity 95+% Fluorochem
Warnings IRRITANT Matrix Scientific

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