COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564389
Chemical Name: (5E)-5-[4-(azepan-1-yl)benzylidene]-1-(2-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccc(cc1)N1CCCCCC1)c1ccccc1F

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Molecular Weight: 423.51
Empirical Formula: C23H22FN3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.476
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 91
Number of rings: 4

     

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