COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK871238
Chemical Name: 1-[(2Z)-2-(2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-5-phenyl-1,3-dithiol-4-yl]ethanone
Smiles: CC(=O)C1=C(S/C(=C/2\c3ccccc3NC(C2=S)(C)C)/S1)c1ccccc1

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Molecular Weight: 409.6
Empirical Formula: C22H19NOS3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.335
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 111
Number of rings: 4

     

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