COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK178854
Chemical Name: (2E)-1-{3,5-bis[(3-methoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-(4-fluorophenyl)prop-2-en-1-one
Smiles: COc1cccc(c1)CNc1nc(nn1C(=O)/C=C/c1ccc(cc1)F)NCc1cccc(c1)OC

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Molecular Weight: 487.53
Empirical Formula: C27H26FN5O3

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 5.026
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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