COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562922
Chemical Name: 1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-methyl-4-[4-(pentyloxy)phenyl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: CCCCCOc1ccc(cc1)C1SCC(=Nc2c1c(C)nn2C1CCOC(C1)(C)C)O

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Molecular Weight: 457.64
Empirical Formula: C25H35N3O3S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.878
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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