COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL491672
Chemical Name: 1-cyclooctyl-4-(pyridin-3-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7(2H,6H)-dione
Smiles: O=C1CSC(c2c(N1)n([nH]c2=O)C1CCCCCCC1)c1cccnc1

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Molecular Weight: 372.49
Empirical Formula: C19H24N4O2S

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 4.021
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 99
Number of rings: 4

     

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