COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL161024
Chemical Name: 1-methyl-4-(3,4,5-trimethoxyphenyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: COc1cc(cc(c1OC)OC)C1SCC(=Nc2c1cnn2C)O

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Molecular Weight: 349.41
Empirical Formula: C16H19N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.622
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 3

     

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