COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK178921
Chemical Name: (2E)-1-{3,5-bis[(2-chlorobenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-phenylprop-2-en-1-one
Smiles: Clc1ccccc1CNc1nc(nn1C(=O)/C=C/c1ccccc1)NCc1ccccc1Cl

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Molecular Weight: 478.38
Empirical Formula: C25H21Cl2N5O

Physical State: Dry powder
Available Amount: 168 mg

Lipinsky:
logP: 6.377
Rotatable bonds: 5
H-donors: 2
H-acceptors: 1
PSA: 71
Number of rings: 4

     

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