UCSF

ZINC39127756

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2010 25 Yes

Popular Name: 4-Benzothiazoleacetic acid, 6-hydroxy-5,7-dimethyl-2-(methylamino)--alpha--3-pyridinyl-, methyl ester 4-Benzothiazoleacetic acid, 6-hy…

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CAS Number: 167889-90-9

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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) 2.98 5.91 -13.5 2 6 0 84 357.435 5 ↓

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