COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK661068
Chemical Name: 4-(2,5-dimethoxyphenyl)-3-methyl-1-(pyrimidin-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: COc1ccc(cc1C1SCC(=Nc2c1c(C)nn2c1ncccn1)O)OC

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Molecular Weight: 397.46
Empirical Formula: C19H19N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.666
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 119
Number of rings: 4

     

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