COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886947
Chemical Name: 8-(3-bromo-5-ethoxy-4-hydroxyphenyl)-3-(4-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Smiles: CCOc1cc(cc(c1O)Br)C1CC(=O)N2C(=C1C#N)SCN(C2)c1ccc(cc1)OC

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Molecular Weight: 516.42
Empirical Formula: C23H22BrN3O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.135
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 111
Number of rings: 4

     

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