COMPOUNDS FOR BIOLOGICAL SCREENING
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Vitas-M Lab ID: STL408232
Chemical Name: N-(cyanomethyl)-2-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5(6H)-yl)acetamide
Smiles: N#CCNC(=O)CN1c2cccnc2Sc2c(C1=O)cccc2

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Molecular Weight: 324.36
Empirical Formula: C16H12N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.125
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 111
Number of rings: 3

     

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