COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406010
Chemical Name: 2-{[4-ethyl-5-(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nnc(n1CC)c1cc2OCCCOc2cc1C

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Molecular Weight: 454.55
Empirical Formula: C23H26N4O4S

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 5.433
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 4

     

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