COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL409316
Chemical Name: 4-[3,5-dimethyl-1-(pyridin-2-yl)-1H-pyrazol-4-yl]-1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-7-hydroxy-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: OC1=Nc2n([nH]c(=O)c2C(SC1)c1c(C)nn(c1C)c1ccccn1)C1CCOC(C1)(C)C

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Molecular Weight: 468.58
Empirical Formula: C23H28N6O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.385
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 130
Number of rings: 5

     

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