COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK228981
Chemical Name: (2E)-1-{5-[(3,4-dimethoxybenzyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}-3-(2-methoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(CNc2nc(nn2C(=O)/C=C/c2ccccc2OC)c2cccnc2)ccc1OC

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Molecular Weight: 471.52
Empirical Formula: C26H25N5O4

Available Amount: 0 mg

Lipinsky:
logP: 4.447
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 4

     

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