UCSF

ZINC00043484

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 Yes

Popular Name: Ethyl 4-amino-2-methylthiothiazole-5-carboxylate Ethyl 4-amino-2-methylthiothiazo…

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CAS Numbers: 39736-29-3 , n / a , [39736-29-3]

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) 1.64 3.34 -6 2 4 0 65 218.303 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 100-102° Oakwood Chemical
MP 80 - 82 Enamine Building Blocks
MP 80...82 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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