COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK063622
Chemical Name: 2-[1-(4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-1-oxo-3-phenylpropan-2-yl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1c2ccccc2c2c(C1(C)C)ssc2=S)C(N1C(=O)c2c(C1=O)cccc2)Cc1ccccc1

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Molecular Weight: 542.7
Empirical Formula: C29H22N2O3S3

Physical State: Dry powder
Available Amount: 476 mg

Lipinsky:
logP: 8.254
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 140
Number of rings: 6

     

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