COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK330565
Chemical Name: dimethyl(2E)-2-{[(2Z)-3-(dimethylamino)-1,4-dioxo-1,4-diphenylbut-2-en-2-yl]sulfanyl}but-2-enedioate
Smiles: COC(=O)/C(=C\C(=O)OC)/S/C(=C(/C(=O)c1ccccc1)\N(C)C)/C(=O)c1ccccc1

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Molecular Weight: 453.52
Empirical Formula: C24H23NO6S

Physical State: Dry powder
Available Amount: 296 mg

Lipinsky:
logP: 3.522
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 115
Number of rings: 2

     

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