COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL318552
Chemical Name: 1-cycloheptyl-7-hydroxy-4-(2-hydroxypyridin-3-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: OC1=Nc2c(C(SC1)c1cccnc1O)c(=O)[nH]n2C1CCCCCC1

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Molecular Weight: 374.46
Empirical Formula: C18H22N4O3S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 1.628
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 123
Number of rings: 4

     

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