COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK178845
Chemical Name: (2E)-1-{3,5-bis[(4-methoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-(2-chlorophenyl)prop-2-en-1-one
Smiles: COc1ccc(cc1)CNc1nn(c(n1)NCc1ccc(cc1)OC)C(=O)/C=C/c1ccccc1Cl

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Molecular Weight: 503.99
Empirical Formula: C27H26ClN5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.396
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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