COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL434037
Chemical Name: 3-(4-methoxyphenyl)-4a-phenyl-1-thioxo-1,2,4a,5-tetrahydropyrimido[1,6-a]benzimidazole-7,8-dicarbonitrile
Smiles: COc1ccc(cc1)C1=CC2(N(C(=S)N1)c1c(N2)cc(c(c1)C#N)C#N)c1ccccc1

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Molecular Weight: 435.51
Empirical Formula: C25H17N5OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.095
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 116
Number of rings: 5

     

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