COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK896741
Chemical Name: (4E)-5-[(4-chlorophenyl)sulfanyl]-2-phenyl-4-(3,4,5-trimethoxybenzylidene)-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1c(OC)cc(cc1OC)/C=C\1/C(=NN(C1=O)c1ccccc1)Sc1ccc(cc1)Cl

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Molecular Weight: 480.97
Empirical Formula: C25H21ClN2O4S

Physical State: Dry powder
Available Amount: 173 mg

Lipinsky:
logP: 6.521
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 85
Number of rings: 4

     

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