COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK592164
Chemical Name: 5-[4-(dimethylamino)phenyl]-4-{[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CN(c1ccc(cc1)c1n[nH]c(=S)n1/N=C/C(=C/c1ccccc1)/C)C

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Molecular Weight: 363.49
Empirical Formula: C20H21N5S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 4.307
Rotatable bonds: 2
H-donors: 1
H-acceptors: 0
PSA: 75
Number of rings: 3

     

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