COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382038
Chemical Name: N-[(1E)-3-[(4-acetylphenyl)amino]-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-4-butoxybenzamide
Smiles: CCCCOc1ccc(cc1)C(=O)N/C(=C/c1ccc2c(c1)OCO2)/C(=O)Nc1ccc(cc1)C(=O)C

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Molecular Weight: 500.55
Empirical Formula: C29H28N2O6

Physical State: Dry powder
Available Amount: 217 mg

Lipinsky:
logP: 5.757
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 102
Number of rings: 4

     

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