COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL291025
Chemical Name: 3-[(2E)-2-(5-bromo-2-methoxybenzylidene)-1-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinyl]-N-tert-butylpropanamide
Smiles: COc1ccc(cc1/C=N/N(C1=NS(=O)(=O)c2c1cccc2)CCC(=O)NC(C)(C)C)Br

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Molecular Weight: 521.44
Empirical Formula: C22H25BrN4O4S

Physical State: Dry powder
Available Amount: 351 mg

Lipinsky:
logP: 3.695
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 3

     

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