COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL081406
Chemical Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-(3,4-dimethoxyphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]acetamide
Smiles: COc1ccc(cc1OC)N1C(=O)C2C(C1=O)N(N=N2)CC(=O)Nc1ccc2c(c1)OCCO2

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Molecular Weight: 467.44
Empirical Formula: C22H21N5O7

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 0.504
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 131
Number of rings: 5

     

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