COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK509098
Chemical Name: (4Z)-4-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-2-(ethylsulfanyl)-1,3-thiazol-5(4H)-one
Smiles: CCSC1=N/C(=C\c2cc3OCOc3cc2Cl)/C(=O)S1

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Molecular Weight: 327.81
Empirical Formula: C13H10ClNO3S2

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 4.674
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 98
Number of rings: 3

     

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