COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK024806
Chemical Name: 1-(4,4,8-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)pentan-1-one
Smiles: CCCCC(=O)N1c2ccc(cc2c2c(C1(C)C)ssc2=S)C

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Molecular Weight: 363.57
Empirical Formula: C18H21NOS3

Physical State: Dry powder
Available Amount: 392 mg

Lipinsky:
logP: 6.513
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 103
Number of rings: 3

     

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