COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL508070
Chemical Name: propyl4-(5-{(1E)-2-cyano-3-[(3,4-dimethylphenyl)amino]-3-oxoprop-1-en-1-yl}furan-2-yl)benzoate
Smiles: CCCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C(/C(=O)Nc1ccc(c(c1)C)C)\C#N

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Molecular Weight: 428.49
Empirical Formula: C26H24N2O4

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 6.645
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 92
Number of rings: 3

     

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