COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK692643
Chemical Name: dimethyl2-(1-chloro-2-phenoxy-2-thioxoethylidene)-1,3-dithiole-4,5-dicarboxylate
Smiles: COC(=O)C1=C(S/C(=C(/C(=S)Oc2ccccc2)\Cl)/S1)C(=O)OC

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Molecular Weight: 402.9
Empirical Formula: C15H11ClO5S3

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 4.616
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 144
Number of rings: 2

     

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