COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042177
Chemical Name: 1-cyclohexyl-4-(2,4-dichlorophenyl)-3-methyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: Clc1ccc(c(c1)Cl)C1SCC(=Nc2c1c(C)nn2C1CCCCC1)O

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Molecular Weight: 410.37
Empirical Formula: C19H21Cl2N3OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.905
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 75
Number of rings: 4

     

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