COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK189996
Chemical Name: (5E)-1-(2,4-dimethylphenyl)-5-[(1-phenyl-1H-pyrrol-2-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccc(c(c1)C)N1C(=S)NC(=O)/C(=C\c2cccn2c2ccccc2)/C1=O

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Molecular Weight: 401.49
Empirical Formula: C23H19N3O2S

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 5.038
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 4

     

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