COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK085349
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)prop-2-enamide
Smiles: O=C(Nc1nnc(s1)C1CCCCC1)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 357.43
Empirical Formula: C18H19N3O3S

Physical State: Dry powder
Available Amount: 277 mg

Lipinsky:
logP: 4.704
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 101
Number of rings: 4

     

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