COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK226681
Chemical Name: (4-{(E)-[1-(3-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-methoxyphenoxy)acetonitrile
Smiles: N#CCOc1ccc(cc1OC)/C=C/1\C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl

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Molecular Weight: 411.8
Empirical Formula: C20H14ClN3O5

Physical State: Dry powder
Available Amount: 358 mg

Lipinsky:
logP: 2.764
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 108
Number of rings: 3

     

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