COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK739822
Chemical Name: ethyl2-({(2E)-3-[5-(3-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoyl}amino)-4-(4-methoxyphenyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)OC)NC(=O)/C(=C/c1ccc(o1)c1cccc(c1)Cl)/C#N

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Molecular Weight: 533
Empirical Formula: C28H21ClN2O5S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 8.575
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 4

     

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