UCSF

ZINC00136656

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 11 Yes

Popular Name: cyclopentane-1,2-dicarboxylic acid cyclopentane-1,2-dicarboxylic acid

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CAS Numbers: 1461-96-7 , 1461-97-8 , 50483-99-3 , [1461-97-8] , [50483-99-3]

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) 0.45 3.43 -120.74 0 4 -2 80 156.137 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 159-163° Oakwood Chemical
mp 160 MolMall (formerly Molecular Diversity Preservation International)
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 98% Fluorochem

Activity (Go SEA)

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