COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK702742
Chemical Name: 2-[(5Z)-5-{[3-(4-butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenylacetate
Smiles: CCCCOc1ccc(cc1C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccccc1OC(=O)C)c1ccccc1

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Molecular Weight: 591.69
Empirical Formula: C33H29N5O4S

Physical State: Dry powder
Available Amount: 405 mg

Lipinsky:
logP: 8.148
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 126
Number of rings: 6

     

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