COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL484692
Chemical Name: (4E)-4-{3-chloro-4-[(4-methylbenzyl)oxy]benzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)COc1ccc(cc1Cl)/C=C/1\C(=NN(C1=O)c1ccccc1)C

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Molecular Weight: 416.91
Empirical Formula: C25H21ClN2O2

Physical State: Dry powder
Available Amount: 976 mg

Lipinsky:
logP: 5.929
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 41
Number of rings: 4

     

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