UCSF

ZINC33975946

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2009 18 Yes

Popular Name: 5-(Piperazin-1-yl)benzofuran-2-carboxamide 5-(Piperazin-1-yl)benzofuran-2-c…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 183288-46-2 , 913730-87-7 , n / a , [183288-46-2]

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) 0.70 1.67 -50.16 4 5 1 76 246.29 2 ↓
Hi High (pH 8-9.5) 3.86 10.86 -6.96 0 4 0 52 321.376 3 ↓
Hi High (pH 8-9.5) 0.70 0.36 -8.38 3 5 0 71 245.282 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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

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