COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL407920
Chemical Name: 1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-7-hydroxy-4-(thiophen-2-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: OC1=Nc2c(C(SC1)c1cccs1)c(=O)[nH]n2C1CCOC(C1)(C)C

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Molecular Weight: 379.5
Empirical Formula: C17H21N3O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.738
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 127
Number of rings: 4

     

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