COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003155
Chemical Name: 3-(3-chloro-1-benzothiophen-2-yl)-4-methyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Smiles: Cn1c(SC/C=C/c2ccccc2)nnc1c1sc2c(c1Cl)cccc2

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Molecular Weight: 397.95
Empirical Formula: C20H16ClN3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.505
Rotatable bonds: 4
H-donors: 0
H-acceptors: 0
PSA: 84
Number of rings: 4

     

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