UCSF

ZINC03883835

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 11 Yes

Popular Name: 5-(5-Bromothiophen-2-yl)-1H-pyrazole 5-(5-Bromothiophen-2-yl)-1H-pyra…

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CAS Numbers: 166196-67-4 , [166196-67-4 , [166196-67-4]

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) 2.71 4.36 -4.06 1 2 0 29 229.102 1 ↓
Ref Reference (pH 7) 2.71 4.39 -5.9 1 2 0 29 229.102 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 167 - 168 KeyOrganics
MP 167-168° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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