COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK902251
Chemical Name: 4-{[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-1-yl]amino}benzonitrile
Smiles: N#Cc1ccc(cc1)N/C=C/C(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 292.29
Empirical Formula: C17H12N2O3

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 2.255
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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