COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL157774
Chemical Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-dimethyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2n(C)nc(c2C(SC1)c1ccc2c(c1)OCCO2)C

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Molecular Weight: 331.4
Empirical Formula: C16H17N3O3S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 1.309
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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