COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK509358
Chemical Name: (4Z)-4-(4-chloro-3-nitrobenzylidene)-2-(ethylsulfanyl)-1,3-thiazol-5(4H)-one
Smiles: CCSC1=N/C(=C\c2ccc(c(c2)[N+](=O)[O-])Cl)/C(=O)S1

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Molecular Weight: 328.8
Empirical Formula: C12H9ClN2O3S2

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 4.259
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 125
Number of rings: 2

     

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