COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521655
Chemical Name: (4Z)-4-(2-nitrobenzylidene)-2-(prop-2-en-1-ylsulfanyl)-1,3-thiazol-5(4H)-one
Smiles: C=CCSC1=N/C(=C\c2ccccc2[N+](=O)[O-])/C(=O)S1

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Molecular Weight: 306.37
Empirical Formula: C13H10N2O3S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.888
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 125
Number of rings: 2

     

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