COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL345102
Chemical Name: (2Z)-N-[2-(1H-benzimidazol-2-yl)ethyl]-3-(1,3-benzodioxol-5-yl)-2-{[(2E)-3-phenylprop-2-enoyl]amino}prop-2-enamide
Smiles: O=C(N/C(=C\c1ccc2c(c1)OCO2)/C(=O)NCCc1nc2c([nH]1)cccc2)/C=C/c1ccccc1

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Molecular Weight: 480.52
Empirical Formula: C28H24N4O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.762
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 105
Number of rings: 5

     

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