COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK118353
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Smiles: COCc1nnc(s1)NC(=O)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 319.34
Empirical Formula: C14H13N3O4S

Physical State: Dry powder
Available Amount: 433 mg

Lipinsky:
logP: 2.486
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 110
Number of rings: 3

     

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