COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054561
Chemical Name: 4-(3,4-dimethoxyphenyl)-1-(4-methylphenyl)-3-phenyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: COc1ccc(cc1OC)C1SCC(=Nc2c1c(nn2c1ccc(cc1)C)c1ccccc1)O

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Molecular Weight: 471.58
Empirical Formula: C27H25N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.486
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 5

     

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