UCSF

ZINC00350743

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 14 No

Popular Name: Methyl 2-amino-1,3-benzothiazole-6-carboxylate Methyl 2-amino-1,3-benzothiazole…

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CAS Numbers: 66947-92-0 , [66947-92-0]

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Annotations

Vendors

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) 2.12 -1.3 -8.9 2 4 0 65 208.242 2 ↓
Lo Low (pH 4.5-6) 2.12 -1.25 -34.64 3 4 1 66 209.25 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 244 - 246 KeyOrganics
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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