COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295602
Chemical Name: (4E)-4-({[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-yl]amino}methylidene)-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Fc1ccc(cc1)N1N=C(/C(=C\Nc2nnc(s2)c2ccc(cc2Cl)Cl)/C1=O)C

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Molecular Weight: 448.31
Empirical Formula: C19H12Cl2FN5OS

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 4.578
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 98
Number of rings: 4

     

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