COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK038819
Chemical Name: methyl4-(5-{(E)-[1-(3,5-dimethylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)-3-methylbenzoate
Smiles: COC(=O)c1ccc(c(c1)C)c1ccc(o1)/C=C/1\C(=O)NC(=S)N(C1=O)c1cc(C)cc(c1)C

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Molecular Weight: 474.54
Empirical Formula: C26H22N2O5S

Physical State: Dry powder
Available Amount: 289 mg

Lipinsky:
logP: 5.914
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 120
Number of rings: 4

     

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