COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK693758
Chemical Name: methyl4-[1-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-7-oxo-4,6,7,8-tetrahydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]benzoate
Smiles: COc1ccc2c(c1)sc(n2)n1nc(c2c1NC(=O)CSC2c1ccc(cc1)C(=O)OC)C

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Molecular Weight: 480.57
Empirical Formula: C23H20N4O4S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.968
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 148
Number of rings: 5

     

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