COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK656491
Chemical Name: 4-[7-hydroxy-3-methyl-1-(pyrimidin-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoicacid
Smiles: OC1=Nc2c(C(SC1)c1ccc(cc1)C(=O)O)c(nn2c1ncccn1)C

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Molecular Weight: 381.42
Empirical Formula: C18H15N5O3S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 0.462
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 138
Number of rings: 4

     

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