COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040798
Chemical Name: (5Z)-5-[4-(azepan-1-yl)benzylidene]-3-(2-chlorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: O=C1N=C(O)/C(=C/c2ccc(cc2)N2CCCCCC2)/C(=O)N1c1ccccc1Cl

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Molecular Weight: 423.9
Empirical Formula: C23H22ClN3O3

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.982
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 73
Number of rings: 4

     

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