COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL190752
Chemical Name: 2-{[2-(4-methylphenyl)-1,1-dioxido-3-oxo-2,3-dihydro-4H-1,2,4-benzothiadiazin-4-yl]methyl}benzonitrile
Smiles: N#Cc1ccccc1CN1C(=O)N(c2ccc(cc2)C)S(=O)(=O)c2c1cccc2

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Molecular Weight: 403.46
Empirical Formula: C22H17N3O3S

Physical State: Dry powder
Available Amount: 8 mg

Lipinsky:
logP: 3.191
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 89
Number of rings: 4

     

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