COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK231353
Chemical Name: (2E)-3-(2-chlorophenyl)-N-[(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]prop-2-enamide
Smiles: O=C(/C=C/c1ccccc1Cl)NCc1nnc(n1C)S

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Molecular Weight: 308.79
Empirical Formula: C13H13ClN4OS

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 2.303
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 98
Number of rings: 2

     

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