COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK800148
Chemical Name: (2Z)-6-(4-chlorobenzyl)-2-{[3-(2,5-dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Smiles: Cc1ccc(c(c1)c1nn(cc1/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)Cl)c1ccccc1)C

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Molecular Weight: 552.06
Empirical Formula: C30H22ClN5O2S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 6.425
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 105
Number of rings: 6

     

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