COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL237638
Chemical Name: 1-cyclohexyl-3-hydroxy-4-[4-(propan-2-yloxy)phenyl]-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: O=C1CSC(c2c(N1)n(nc2O)C1CCCCC1)c1ccc(cc1)OC(C)C

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Molecular Weight: 401.53
Empirical Formula: C21H27N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.247
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 101
Number of rings: 4

     

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