COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK640888
Chemical Name: (2E)-3-(2,4-dichlorophenyl)-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]prop-2-en-1-one
Smiles: Clc1ccc(c(c1)Cl)/C=C/C(=O)N1CCC(CC1)c1nnc2n1cccc2

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Molecular Weight: 401.29
Empirical Formula: C20H18Cl2N4O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.862
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 50
Number of rings: 4

     

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