COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK692814
Chemical Name: 4-(4-hydroxy-3,5-dimethoxyphenyl)-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: COc1ccc2c(c1)sc(n2)n1nc(c2c1NC(=O)CSC2c1cc(OC)c(c(c1)OC)O)C

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Molecular Weight: 498.58
Empirical Formula: C23H22N4O5S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.544
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 161
Number of rings: 5

     

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