COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368762
Chemical Name: (2E)-2-cyano-N-cyclohexyl-3-(3-{2-[(3,4-dimethylphenyl)amino]-2-oxoethoxy}phenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cccc(c1)OCC(=O)Nc1ccc(c(c1)C)C)/C(=O)NC1CCCCC1

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Molecular Weight: 431.53
Empirical Formula: C26H29N3O3

Physical State: Dry powder
Available Amount: 233 mg

Lipinsky:
logP: 4.652
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 3

     

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