COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK395088
Chemical Name: dimethyl2-{1-[(4-fluorophenoxy)acetyl]-2,2,7-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Smiles: COC(=O)C1=C(S/C(=C\2/C(=S)C(C)(C)N(c3c2ccc(c3)C)C(=O)COc2ccc(cc2)F)/S1)C(=O)OC

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Molecular Weight: 573.69
Empirical Formula: C27H24FNO6S3

Physical State: Dry powder
Available Amount: 527 mg

Lipinsky:
logP: 6.009
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 164
Number of rings: 4

     

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