COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK959745
Chemical Name: (2E)-1-{4-[(4-bromo-1-methyl-1H-pyrazol-3-yl)carbonyl]piperazin-1-yl}-3-(4-chlorophenyl)prop-2-en-1-one
Smiles: O=C(N1CCN(CC1)C(=O)c1nn(cc1Br)C)/C=C/c1ccc(cc1)Cl

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Molecular Weight: 437.72
Empirical Formula: C18H18BrClN4O2

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 0.716
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 58
Number of rings: 3

     

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