COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374170
Chemical Name: (5E)-5-[3-bromo-5-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-1-(4-chlorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1cc(/C=C/2\C(=O)NC(=S)N(C2=O)c2ccc(cc2)Cl)cc(c1OCc1cccc2c1cccc2)Br

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Molecular Weight: 607.91
Empirical Formula: C29H20BrClN2O4S

Physical State: Dry powder
Available Amount: 610 mg

Lipinsky:
logP: 7.317
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 5

     

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