COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK949791
Chemical Name: ethyl4-(4-chlorophenyl)-2-{[(2E)-2-cyano-3-(3-nitrophenyl)prop-2-enoyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)Cl)NC(=O)/C(=C/c1cccc(c1)[N+](=O)[O-])/C#N

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Molecular Weight: 481.92
Empirical Formula: C23H16ClN3O5S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 7.254
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 153
Number of rings: 3

     

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