UCSF

ZINC17179649

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2008 15 No

Popular Name: 4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-amine 4-(3-bromo-4-methoxyphenyl)-1,3-…

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CAS Number: 189011-00-5

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) 2.94 4.51 -7.02 2 3 0 48 285.166 2 ↓
Mid Mid (pH 6-8) 2.94 4.57 -34.16 1 3 -1 46 284.158 2 ↓
Lo Low (pH 4.5-6) 2.94 4.87 -32.89 3 3 1 49 286.174 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 188 - 190 Enamine Building Blocks
MP 188...190 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% )