COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK140775
Chemical Name: methyl4-(3-{(E)-[1-(2,4-dimethylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(cc1C)C

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Molecular Weight: 487.58
Empirical Formula: C27H25N3O4S

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 5.936
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 4

     

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