COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK187633
Chemical Name: (2E)-1-{3,5-bis[(3,4-dimethoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-(2-methoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(CNc2nn(c(n2)NCc2ccc(c(c2)OC)OC)C(=O)/C=C/c2ccccc2OC)ccc1OC

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Molecular Weight: 559.62
Empirical Formula: C30H33N5O6

Physical State: Dry powder
Available Amount: 154 mg

Lipinsky:
logP: 4.666
Rotatable bonds: 11
H-donors: 2
H-acceptors: 6
PSA: 117
Number of rings: 4

     

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