COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK777945
Chemical Name: 4-[4-(benzyloxy)phenyl]-1-cyclohexyl-3-hydroxy-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: O=C1CSC(c2c(N1)n(nc2O)C1CCCCC1)c1ccc(cc1)OCc1ccccc1

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Molecular Weight: 449.57
Empirical Formula: C25H27N3O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.024
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 101
Number of rings: 5

     

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