COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL282673
Chemical Name: ethyl(2E)-3-(4-chlorophenyl)-2-cyanoprop-2-enoate
Smiles: CCOC(=O)/C(=C/c1ccc(cc1)Cl)/C#N

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Molecular Weight: 235.67
Empirical Formula: C12H10ClNO2

Physical State: Dry powder
Available Amount: 3680 mg

Lipinsky:
logP: 2.884
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 50
Number of rings: 1

     

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