COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK592030
Chemical Name: (5E)-1-(2,5-dimethylphenyl)-5-[(2-phenyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccc(c(c1)N1C(=NC(=O)/C(=C\c2c([nH]c3c2cccc3)c2ccccc2)/C1=O)S)C

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Molecular Weight: 451.55
Empirical Formula: C27H21N3O2S

Physical State: Dry powder
Available Amount: 209 mg

Lipinsky:
logP: 7.079
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 104
Number of rings: 5

     

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