COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL290990
Chemical Name: 4-tert-butyl-N'-(2-cyanoethyl)-N'-(1,1-dioxido-1,2-benzothiazol-3-yl)benzohydrazide
Smiles: N#CCCN(C1=NS(=O)(=O)c2c1cccc2)NC(=O)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 410.5
Empirical Formula: C21H22N4O3S

Physical State: Dry powder
Available Amount: 640 mg

Lipinsky:
logP: 2.899
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 3

     

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