COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK818777
Chemical Name: 2-{(5Z)-6-oxo-5-[4-(propan-2-yl)benzylidene]-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl}phenylacetate
Smiles: CC(=O)Oc1ccccc1c1nn2c(n1)s/c(=C\c1ccc(cc1)C(C)C)/c2=O

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Saltdata: 1/6CH3COOH
Molecular Weight: 405.48
Empirical Formula: C22H19N3O3S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 5.562
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 99
Number of rings: 4

     

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