COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL361130
Chemical Name: (8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(4-nitrophenyl)methanone
Smiles: CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)c1ccc(cc1)[N+](=O)[O-])(C)C

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Molecular Weight: 458.58
Empirical Formula: C21H18N2O4S3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.669
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 158
Number of rings: 4

     

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