COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL365607
Chemical Name: 2-{[5-benzyl-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1-ethyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2cn(c3c2cccc3)CC)nnc1Cc1ccccc1

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Molecular Weight: 482.61
Empirical Formula: C28H26N4O2S

Physical State: Dry powder
Available Amount: 1692 mg

Lipinsky:
logP: 6.468
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 87
Number of rings: 5

     

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