UCSF

ZINC01509173

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2004 15 Yes

Popular Name: ethyl 5-bromo-1H-indole-2-carboxylate ethyl 5-bromo-1H-indole-2-carbox…

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CAS Numbers: 16372-70-0 , 16732-70-0 , [16732-70-0]

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) 3.39 0.14 -5.29 1 3 0 42 268.11 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 163-167° Oakwood Chemical
MP 165 TCI
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

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