COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK095120
Chemical Name: 4-{[(3E)-5-(4-chlorophenyl)-3-(4-ethoxybenzylidene)-2-oxo-2,3-dihydro-1H-pyrrol-1-yl]methyl}benzoicacid
Smiles: CCOc1ccc(cc1)/C=C/1\C=C(N(C1=O)Cc1ccc(cc1)C(=O)O)c1ccc(cc1)Cl

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Molecular Weight: 459.93
Empirical Formula: C27H22ClNO4

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 6.777
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 66
Number of rings: 4

     

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