COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL363674
Chemical Name: 2-({4-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}methyl)benzonitrile
Smiles: N#Cc1ccccc1COc1ccc(cc1)C=C1C(=O)N(C)C(=S)N(C1=O)C

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Molecular Weight: 391.45
Empirical Formula: C21H17N3O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.304
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 105
Number of rings: 3

     

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