COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK600545
Chemical Name: (5E)-5-(3-bromo-4-hydroxy-5-methoxybenzylidene)-6-hydroxy-3-[4-(propan-2-yl)phenyl]pyrimidine-2,4(3H,5H)-dione
Smiles: COc1cc(/C=C/2\C(=NC(=O)N(C2=O)c2ccc(cc2)C(C)C)O)cc(c1O)Br

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Molecular Weight: 459.3
Empirical Formula: C21H19BrN2O5

Physical State: Dry powder
Available Amount: 208 mg

Lipinsky:
logP: 4.4
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 99
Number of rings: 3

     

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