UCSF

ZINC03957442

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2005 13 Yes

Popular Name: Ethyl 2,6-dimethylnicotinate Ethyl 2,6-dimethylnicotinate

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CAS Numbers: 1721-13-7 , [1721-13-7]

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) 1.35 5.41 -6.23 0 3 0 39 179.219 3 ↓

Vendor Notes

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

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