COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK692836
Chemical Name: 4-(4-ethoxy-3-methoxyphenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: CCOc1ccc(cc1OC)C1SCC(=O)Nc2c1c(C)nn2c1nc2c(s1)cc(cc2)OC

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Molecular Weight: 496.61
Empirical Formula: C24H24N4O4S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.258
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 141
Number of rings: 5

     

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