COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK113174
Chemical Name: (4E)-4-{4-[(4-chlorophenyl)sulfanyl]benzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(cc1)Sc1ccc(cc1)/C=C/1\C(=NN(C1=O)c1ccccc1)C

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Molecular Weight: 404.92
Empirical Formula: C23H17ClN2OS

Physical State: Dry powder
Available Amount: 445 mg

Lipinsky:
logP: 6.38
Rotatable bonds: 0
H-donors: 0
H-acceptors: 1
PSA: 57
Number of rings: 4

     

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