COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK670497
Chemical Name: (4E)-2-(3,4-dimethylphenyl)-5-methyl-4-({[4-(piperidin-1-ylsulfonyl)phenyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/Nc1ccc(cc1)S(=O)(=O)N1CCCCC1)c1ccc(c(c1)C)C

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Molecular Weight: 452.58
Empirical Formula: C24H28N4O3S

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 3.97
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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