COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL310530
Chemical Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1H-1,2,4-triazol-5-yl}acetamide
Smiles: COc1cc(CCc2n[nH]c(n2)NC(=O)Cc2ccc3c(c2)OCCCO3)ccc1OC

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Molecular Weight: 438.48
Empirical Formula: C23H26N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.724
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 107
Number of rings: 4

     

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