COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406134
Chemical Name: 2-{[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nnc(n1c1ccccc1)Cc1ccc2c(c1)OCCCO2

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Molecular Weight: 396.47
Empirical Formula: C20H20N4O3S

Physical State: Dry powder
Available Amount: 31 mg

Lipinsky:
logP: 3.388
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 117
Number of rings: 4

     

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