COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473570
Chemical Name: ethyl2-{[(2E)-2-cyano-3-(3-{[(2,4-dichlorophenyl)carbonyl]oxy}phenyl)prop-2-enoyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1ccsc1NC(=O)/C(=C/c1cccc(c1)OC(=O)c1ccc(cc1Cl)Cl)/C#N

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Molecular Weight: 515.37
Empirical Formula: C24H16Cl2N2O5S

Physical State: Dry powder
Available Amount: 377 mg

Lipinsky:
logP: 7.648
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 133
Number of rings: 3

     

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