COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295733
Chemical Name: 4-({(E)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-3-methoxyphenylthiocyanate
Smiles: N#CSc1ccc(c(c1)OC)N/C=C/1\C(=NN(C1=O)c1ccc(cc1)Cl)C

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Molecular Weight: 398.87
Empirical Formula: C19H15ClN4O2S

Physical State: Dry powder
Available Amount: 225 mg

Lipinsky:
logP: 3.027
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 103
Number of rings: 3

     

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