COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374941
Chemical Name: 2-[(4-{(E)-[1-(4-tert-butylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)methyl]benzonitrile
Smiles: N#Cc1ccccc1COc1ccc(cc1)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 479.54
Empirical Formula: C29H25N3O4

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 5.379
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 4

     

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