COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK657076
Chemical Name: 3-methyl-1-(pyrimidin-2-yl)-4-(2,4,5-trimethoxyphenyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: COc1cc(OC)c(cc1C1SCC(=Nc2c1c(C)nn2c1ncccn1)O)OC

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Molecular Weight: 427.48
Empirical Formula: C20H21N5O4S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 0.368
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 129
Number of rings: 4

     

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