UCSF

ZINC39376515

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2010 8 No

Popular Name: (4S,5S)-4-hydroxy-5-methyl-cyclopent-2-en-1-one (4S,5S)-4-hydroxy-5-methyl-cyclo…

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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) -0.04 0.68 -8.01 1 2 0 37 112.128 0 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0102066A1; EP0115860A2; US4535182; US4665174; US4729953; US4970345 IBM Patent Data

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