COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052332
Chemical Name: ethyl(2Z)-3-amino-4,4,4-trichloro-2-cyanobut-2-enoate
Smiles: CCOC(=O)/C(=C(/C(Cl)(Cl)Cl)\N)/C#N

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Molecular Weight: 257.5
Empirical Formula: C7H7Cl3N2O2

Physical State: Dry powder
Available Amount: 271 mg

Lipinsky:
logP: 3.311
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 76
Number of rings: 0

     

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