COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK317567
Chemical Name: (2E)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-N-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]prop-2-enamide
Smiles: COc1ccc(cc1COc1ccc(cc1)Br)/C=C/C(=O)Nc1c(C)nn(c1C)Cc1ccccc1Cl

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Molecular Weight: 580.91
Empirical Formula: C29H27BrClN3O3

Physical State: Dry powder
Available Amount: 25 mg

Lipinsky:
logP: 7.797
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 65
Number of rings: 4

     

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