UCSF

ZINC34329853

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2009 15 Yes

Popular Name: 1-benzyl-3,4-dimethyl-2H-pyrrol-5-one 1-benzyl-3,4-dimethyl-2H-pyrrol-…

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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) 2.54 7.36 -11.95 0 2 0 20 201.269 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5021587 IBM Patent Data

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