COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL070009
Chemical Name: 2-(1,3-benzothiazol-2-yl)-4-methyl-5-(3-methylbutyl)-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]pyridin-6-olate
Smiles: CC(CCn1c([O-])cc2c(c1C)c(=O)n(n2)c1nc2c(s1)cccc2)C

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Saltdata: Na+
Molecular Weight: 367.45
Empirical Formula: C19H19N4O2S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 3.672
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 4

     

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