COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK827053
Chemical Name: 3',9'-bis(4-fluorophenyl)-6'-thioxo-3',4',9',10'-tetrahydro-2'H-spiro[cyclohexane-1,12'-[1,3,5,9]tetraaza[7,11]methano[1,3,5]triazino[1,2-a][1,5]diazocine]-7',11'(6'H,8'H)-dicarbonitrile
Smiles: N#CC12CN(CC(C32CCCCC3)(C2=NCN(CN2C1=S)c1ccc(cc1)F)C#N)c1ccc(cc1)F

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Molecular Weight: 516.62
Empirical Formula: C28H26F2N6S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.139
Rotatable bonds: 0
H-donors: 0
H-acceptors: 0
PSA: 101
Number of rings: 6

     

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