COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL122382
Chemical Name: 2-({5-[(2,6-dimethylphenoxy)methyl]-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone
Smiles: CC(n1c(SCC(=O)N2CCN(CC2)c2ccc(cc2)F)nnc1COc1c(C)cccc1C)C

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Molecular Weight: 497.64
Empirical Formula: C26H32FN5O2S

Physical State: Dry powder
Available Amount: 268 mg

Lipinsky:
logP: 5.029
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 88
Number of rings: 4

     

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