COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK827326
Chemical Name: 8-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(4-butylphenyl)-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)c1cc(Br)c(c(c1)OC)O

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Molecular Weight: 528.47
Empirical Formula: C25H26BrN3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.853
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 102
Number of rings: 4

     

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