UCSF

ZINC14983507

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 14 Yes

Popular Name: Methyl 3-iodo-1H-indazole-6-carboxylate Methyl 3-iodo-1H-indazole-6-carb…

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CAS Numbers: 885518-82-1 , [885518-82-1]

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) 2.98 4.68 -6.05 1 4 0 55 302.071 2 ↓
Ref Reference (pH 7) 2.98 4.75 -7.07 1 4 0 55 302.071 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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