COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK036512
Chemical Name: 3-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 455.62
Empirical Formula: C28H29N3OS

Physical State: Dry powder
Available Amount: 408 mg

Lipinsky:
logP: 9.038
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 65
Number of rings: 4

     

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