UCSF

ZINC00437559

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 25 No

Popular Name: Benzobarbital Benzobarbital

Find On: PubMed — Wikipedia — Google

CAS Numbers: 744-80-9 , [744-80-9]

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) 1.79 5.65 -50.3 0 6 -1 90 335.339 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 99.0% APIChem

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