COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL299175
Chemical Name: 2-{[5-(4-tert-butylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(naphthalen-2-yl)ethanone
Smiles: C=CCn1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 441.6
Empirical Formula: C27H27N3OS

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 8.089
Rotatable bonds: 6
H-donors: 0
H-acceptors: 1
PSA: 73
Number of rings: 4

     

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