COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL081466
Chemical Name: 1-(2,5-dimethylbenzyl)-5-(4-ethoxyphenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)C2C(C1=O)N(N=N2)Cc1cc(C)ccc1C

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Molecular Weight: 378.43
Empirical Formula: C21H22N4O3

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 2.455
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 74
Number of rings: 4

     

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