COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK870756
Chemical Name: (2E)-3-phenyl-1-(4,4,6-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)prop-2-en-1-one
Smiles: O=C(N1c2c(C)cccc2c2c(C1(C)C)ssc2=S)/C=C/c1ccccc1

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Molecular Weight: 409.6
Empirical Formula: C22H19NOS3

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 6.884
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 103
Number of rings: 4

     

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