COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK818321
Chemical Name: (5Z)-5-[4-(diethylamino)benzylidene]-2-[4-(hexyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: CCCCCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1ccc(cc1)N(CC)CC)/s2

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Molecular Weight: 476.64
Empirical Formula: C27H32N4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 9.464
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 85
Number of rings: 4

     

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