COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK222355
Chemical Name: (2E)-3-(4-methoxyphenyl)-1-{5-[(4-methylbenzyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}prop-2-en-1-one
Smiles: COc1ccc(cc1)/C=C/C(=O)n1nc(nc1NCc1ccc(cc1)C)c1cccnc1

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Molecular Weight: 425.49
Empirical Formula: C25H23N5O2

Physical State: Dry powder
Available Amount: 172 mg

Lipinsky:
logP: 5.11
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 81
Number of rings: 4

     

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