COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL016980
Chemical Name: (2E)-3-(4-tert-butylphenyl)-N-[5-(3-chloro-4-methylbenzyl)-1,3-thiazol-2-yl]-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)C(C)(C)C)/C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)C

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Molecular Weight: 450
Empirical Formula: C25H24ClN3OS

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 7.308
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 94
Number of rings: 3

     

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