COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383138
Chemical Name: 2-({(E)-[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-1H-isoindole-1,3(2H)-dione
Smiles: Clc1cccc(c1)N1N=C(/C(=C\NN2C(=O)c3c(C2=O)cccc3)/C1=O)C

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Molecular Weight: 380.79
Empirical Formula: C19H13ClN4O3

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 2.178
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 82
Number of rings: 4

     

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