COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681509
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Smiles: Cc1ccc(c(c1)OCc1nnc(n1c1ccccc1)SCC(=O)c1ccc2c(c1)OCCO2)C(C)C

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Molecular Weight: 515.63
Empirical Formula: C29H29N3O4S

Physical State: Dry powder
Available Amount: 5 mg

Lipinsky:
logP: 7.844
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 5

     

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