COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295000
Chemical Name: 6-{[2-({(E)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)phenyl]sulfanyl}-1H,3H-benzo[de]isochromene-1,3-dione
Smiles: Clc1ccc(cc1)N1N=C(/C(=C\Nc2ccccc2Sc2ccc3c4c2cccc4C(=O)OC3=O)/C1=O)C

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Molecular Weight: 540
Empirical Formula: C29H18ClN3O4S

Physical State: Dry powder
Available Amount: 267 mg

Lipinsky:
logP: 4.355
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 6

     

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