COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK870878
Chemical Name: 1-(7-methoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenoxyethanone
Smiles: COc1ccc2c(c1)N(C(=O)COc1ccccc1)C(c1c2c(=S)ss1)(C)C

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Molecular Weight: 429.58
Empirical Formula: C21H19NO3S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.608
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 121
Number of rings: 4

     

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