UCSF

ZINC35100101

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2009 12 Yes

Popular Name: methyl 2-{bicyclo[2.2.1]heptan-2-yl}acetate methyl 2-{bicyclo[2.2.1]heptan-2…

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CAS Number: 54441-24-6

Other Names:

MFCD08457156

MFCD13593679

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) 2.05 6.43 -4.56 0 2 0 26 168.236 3 ↓

Vendor Notes

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

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