COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL421008
Chemical Name: (4-benzylpiperazin-1-yl)(3-methyl-1,1-dioxido-4-propyl-4H-1,2,4-benzothiadiazin-7-yl)methanone
Smiles: CCCN1C(=NS(=O)(=O)c2c1ccc(c2)C(=O)N1CCN(CC1)Cc1ccccc1)C

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Molecular Weight: 440.57
Empirical Formula: C23H28N4O3S

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 0.875
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 81
Number of rings: 4

     

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