COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL081797
Chemical Name: 5-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-{2-[(2,5-dimethylphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide
Smiles: O=C(Nc1cc(C)ccc1C)Cn1nnc(c1N)C(=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 422.44
Empirical Formula: C21H22N6O4

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 1.886
Rotatable bonds: 5
H-donors: 4
H-acceptors: 4
PSA: 133
Number of rings: 4

     

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