COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK951134
Chemical Name: N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Smiles: O=C(c1ccc2c(c1)OCCCO2)Nc1nnc(s1)SCc1ccccc1

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S NH N N S O O O
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Molecular Weight: 399.49
Empirical Formula: C19H17N3O3S2

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.911
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 4

     

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