COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL162185
Chemical Name: methyl(2E)-2-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylacetyl)imino]-4-(2-methoxy-2-oxoethyl)-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: COC(=O)c1s/c(=N/C(=O)Cc2ccc3c(c2)OCCCO3)/[nH]c1CC(=O)OC

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Molecular Weight: 420.44
Empirical Formula: C19H20N2O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.701
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 137
Number of rings: 3

     

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