COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK816088
Chemical Name: (5Z)-5-(4-butoxy-3-ethoxybenzylidene)-2-(4-butoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: CCCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1ccc(c(c1)OCC)OCCCC)/s2

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Molecular Weight: 493.63
Empirical Formula: C27H31N3O4S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 8.785
Rotatable bonds: 10
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 4

     

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