COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK670457
Chemical Name: diethyl5-{[(E)-2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin-12-ylmethylidene]amino}-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(/N=C/c2ccc3c(c2)OCCOCCOCCO3)sc(c1C)C(=O)OCC

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Molecular Weight: 491.56
Empirical Formula: C24H29NO8S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.03
Rotatable bonds: 7
H-donors: 0
H-acceptors: 8
PSA: 130
Number of rings: 3

     

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