COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL367740
Chemical Name: N-(2-cyanoethyl)-N-({5-[(E)-(4,6-dioxo-1-phenyl-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}methyl)methanesulfonamide
Smiles: N#CCCN(S(=O)(=O)C)Cc1ccc(o1)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccccc1

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Molecular Weight: 458.52
Empirical Formula: C20H18N4O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.898
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 164
Number of rings: 3

     

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