COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK653869
Chemical Name: 3-methyl-4-[3-(propan-2-yloxy)phenyl]-1-(pyrimidin-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: CC(Oc1cccc(c1)C1SCC(=Nc2c1c(C)nn2c1ncccn1)O)C

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Molecular Weight: 395.49
Empirical Formula: C20H21N5O2S

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 1.58
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 110
Number of rings: 4

     

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