COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808971
Chemical Name: ethyl4-(4-methylphenyl)-2-[(2,2,2-trichloro-1-{[(2E)-3-phenylprop-2-enoyl]amino}ethyl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(C(Cl)(Cl)Cl)NC(=O)/C=C/c1ccccc1

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Molecular Weight: 537.89
Empirical Formula: C25H23Cl3N2O3S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 8.911
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 95
Number of rings: 3

     

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