COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL145627
Chemical Name: N-(2-chlorobenzyl)-6-[1-(4-nitrobenzyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide
Smiles: O=C(NCc1ccccc1Cl)CCCCCn1c(=O)c2sccc2n(c1=O)Cc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 541.03
Empirical Formula: C26H25ClN4O5S

Physical State: Dry powder
Available Amount: 12 mg

Lipinsky:
logP: 4.767
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 143
Number of rings: 4

     

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