UCSF

ZINC11535745

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2008 10 No

Popular Name: Methyl 2-aminothiazole-5-carboxylate Methyl 2-aminothiazole-5-carboxy…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 6633-61-0 , [32955-21-8]

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) 0.55 1.44 -8.29 2 4 0 65 158.182 2 ↓
Lo Low (pH 4.5-6) 0.55 1.85 -35.44 3 4 1 66 159.19 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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Rings

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

No pre-computed analogs available. Try a structural similarity search.