COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL361141
Chemical Name: (4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(3-nitrophenyl)methanone
Smiles: O=C(N1c2ccccc2c2c(C1(C)C)ssc2=S)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 414.53
Empirical Formula: C19H14N2O3S3

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 5.213
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 148
Number of rings: 4

     

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