COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL153423
Chemical Name: 4-(7-chloro-1,3-benzodioxol-5-yl)-1,3-dimethyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2n(C)nc(c2C(SC1)c1cc(Cl)c2c(c1)OCO2)C

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Molecular Weight: 351.81
Empirical Formula: C15H14ClN3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.063
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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