COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK790973
Chemical Name: 1-amino-3-(3,4-dimethoxyphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile
Smiles: COc1cc(ccc1OC)C1C(=C(N)n2c(=C1C#N)sc1c2cccc1)C#N

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Molecular Weight: 388.45
Empirical Formula: C21H16N4O2S

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 1.832
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 120
Number of rings: 4

     

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