COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK571496
Chemical Name: (5E)-5-[(1-benzyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]-1-butyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCCCN1C(=NC(=O)/C(=C\c2ccc3c(c2)CCCN3Cc2ccccc2)/C1=O)S

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Molecular Weight: 433.57
Empirical Formula: C25H27N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.057
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 91
Number of rings: 4

     

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