COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL490332
Chemical Name: 4-[(E)-2-(3-nitrophenyl)ethenyl]-3,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: NC1=Nc2n(C(N1)/C=C/c1cccc(c1)[N+](=O)[O-])c1c(n2)cccc1

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Molecular Weight: 334.34
Empirical Formula: C17H14N6O2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.084
Rotatable bonds: 2
H-donors: 3
H-acceptors: 2
PSA: 114
Number of rings: 4

     

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