COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL479802
Chemical Name: 4-[(1E)-3-(butylamino)-2-cyano-3-oxoprop-1-en-1-yl]phenyl6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoate
Smiles: CCCCNC(=O)/C(=C/c1ccc(cc1)OC(=O)CCCCCN1C(=O)c2c(C1=O)cccc2)/C#N

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Molecular Weight: 487.56
Empirical Formula: C28H29N3O5

Available Amount: 0 mg

Lipinsky:
logP: 4.527
Rotatable bonds: 10
H-donors: 1
H-acceptors: 5
PSA: 116
Number of rings: 3

     

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