UCSF

ZINC39351813

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2010 12 Yes

Popular Name: ETHYL 4-METHYLPIPERIDINE-4-CARBOXYLATE ETHYL 4-METHYLPIPERIDINE-4-CARBO…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 103039-88-9 , 225240-71-1 , [103039-88-9] , [225240-71-1]

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) 1.00 4.31 -44.51 2 3 1 43 172.248 3 ↓
Hi High (pH 8-9.5) -0.77 2.19 -97.3 11 11 2 191 422.497 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 133 - 135 Enamine Building Blocks
MP 133...135 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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