COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416452
Chemical Name: (5E)-5-[(1-tert-butyl-1H-pyrrol-2-yl)methylidene]-1-(3,5-dimethylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Cc1cc(C)cc(c1)N1C(=S)NC(=O)/C(=C\c2cccn2C(C)(C)C)/C1=O

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Molecular Weight: 381.5
Empirical Formula: C21H23N3O2S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.396
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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