COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL236506
Chemical Name: 3-hydroxy-4-[4-(pentyloxy)phenyl]-1-(propan-2-yl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: CCCCCOc1ccc(cc1)C1SCC(=O)Nc2c1c(O)nn2C(C)C

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Molecular Weight: 389.52
Empirical Formula: C20H27N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.313
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 101
Number of rings: 3

     

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