UCSF

ZINC34541313

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2009 14 Yes

Popular Name: [(1S,4R)-4-acetamidocyclopent-2-en-1-yl]methyl [(1S,4R)-4-acetamidocyclopent-2-…

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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) 0.54 4.14 -10.81 1 4 0 55 197.234 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0349242A2; EP0349242B1; EP0361831A1; EP0361831B1; EP0434450A2; EP0434450A3; EP0434450B1; EP0921114A1; EP0921121A1; US5049671; US5175292; US5922694 IBM Patent Data
PUBCHEM_PATENT_ID US5567703 IBM Patent Data

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.