COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK328618
Chemical Name: sodium5-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-benzothiazol-2-yl)-4-methyl-3,6-dioxo-2,3,5,6-tetrahydropyrazolo[4,3-c]pyridin-1-ide
Smiles: O=c1cc2[n-]n(c(=O)c2c(n1Cc1ccc2c(c1)OCO2)C)c1nc2c(s1)cccc2.[Na+]

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Molecular Weight: 454.44
Empirical Formula: C22H15N4NaO4S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 0
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 6

     

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