COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK168319
Chemical Name: ethyl(4Z)-4-(4-chlorobenzylidene)-2-methyl-5-oxo-1-(prop-2-en-1-yl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: C=CCN1C(=O)/C(=C\c2ccc(cc2)Cl)/C(=C1C)C(=O)OCC

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Molecular Weight: 331.8
Empirical Formula: C18H18ClNO3

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 3.998
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 46
Number of rings: 2

     

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