COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL316049
Chemical Name: methyl4-(1-benzyl-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1SCC(=Nc2c1cnn2Cc1ccccc1)O

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Molecular Weight: 393.47
Empirical Formula: C21H19N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.774
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 102
Number of rings: 4

     

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