COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL361241
Chemical Name: (7-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(4-nitrophenyl)methanone
Smiles: COc1ccc2c(c1)N(C(=O)c1ccc(cc1)[N+](=O)[O-])C(c1c2c(=S)ss1)(C)C

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Molecular Weight: 444.56
Empirical Formula: C20H16N2O4S3

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 5.208
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 158
Number of rings: 4

     

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