COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK227585
Chemical Name: (2E)-3-(2-chlorophenyl)-1-{5-[(4-methoxybenzyl)amino]-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl}prop-2-en-1-one
Smiles: COc1ccc(cc1)CNc1nc(nn1C(=O)/C=C/c1ccccc1Cl)c1cccnc1

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Molecular Weight: 445.91
Empirical Formula: C24H20ClN5O2

Physical State: Dry powder
Available Amount: 127 mg

Lipinsky:
logP: 4.998
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 81
Number of rings: 4

     

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