COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL334480
Chemical Name: ethyl2-{[(2E)-3-(1-benzyl-1H-indol-3-yl)-2-cyanoprop-2-enoyl]amino}benzoate
Smiles: CCOC(=O)c1ccccc1NC(=O)/C(=C/c1cn(c2c1cccc2)Cc1ccccc1)/C#N

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Molecular Weight: 449.51
Empirical Formula: C28H23N3O3

Physical State: Dry powder
Available Amount: 220 mg

Lipinsky:
logP: 7.042
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 84
Number of rings: 4

     

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