COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473149
Chemical Name: (2E)-3-[1-(4-chlorobenzyl)-3-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]-2-cyano-N-(1,3-thiazol-2-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1ccc(c(c1)OC)OC)Cc1ccc(cc1)Cl)/C(=O)Nc1nccs1

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Molecular Weight: 505.98
Empirical Formula: C25H20ClN5O3S

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 4.127
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 130
Number of rings: 4

     

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