COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL161080
Chemical Name: 4-{3-[(4-fluorobenzyl)oxy]-4-methoxyphenyl}-1,3-dimethyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: COc1ccc(cc1OCc1ccc(cc1)F)C1SCC(=Nc2c1c(C)nn2C)O

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Molecular Weight: 427.5
Empirical Formula: C22H22FN3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.087
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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