COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323180
Chemical Name: ethyl(2E,4E)-4-{1-[2-(4-chlorophenyl)-2-oxoethyl]quinolin-4(1H)-ylidene}-2-cyanobut-2-enoate
Smiles: CCOC(=O)/C(=C/C=c/1\ccn(c2c1cccc2)CC(=O)c1ccc(cc1)Cl)/C#N

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Molecular Weight: 418.88
Empirical Formula: C24H19ClN2O3

Physical State: Dry powder
Available Amount: 83 mg

Lipinsky:
logP: 3.634
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 70
Number of rings: 3

     

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