COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL020639
Chemical Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Smiles: COc1cc(CCN2C(=O)C3C(C2=O)N=NN3c2ccccc2)ccc1OC

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Molecular Weight: 380.4
Empirical Formula: C20H20N4O4

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 1.851
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 83
Number of rings: 4

     

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