COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK827394
Chemical Name: 3-(4-butylphenyl)-8-{4-[(4-chlorobenzyl)oxy]phenyl}-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: CCCCc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1ccc(cc1)OCc1ccc(cc1)Cl

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Molecular Weight: 544.12
Empirical Formula: C31H30ClN3O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.942
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 81
Number of rings: 5

     

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