COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL455097
Chemical Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[4-{[(4-methoxyphenyl)sulfanyl]methyl}-1-(prop-2-en-1-yl)-1H-1,2,3-triazol-5-yl]acetamide
Smiles: C=CCn1nnc(c1CC(=O)Nc1ccc2c(c1)OCCCO2)CSc1ccc(cc1)OC

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Molecular Weight: 466.56
Empirical Formula: C24H26N4O4S

Available Amount: 0 mg

Lipinsky:
logP: 3.345
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 4

     

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