COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL133029
Chemical Name: methyl3-{[(3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)carbonyl]amino}benzoate
Smiles: COC(=O)c1cccc(c1)NC(=O)c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C)CC

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Molecular Weight: 525.63
Empirical Formula: C26H31N5O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.066
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 122
Number of rings: 4

     

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