COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK195899
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-2-(4-methylphenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc2c(c1)OCO2)/c1ccc(cc1)C

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Molecular Weight: 263.3
Empirical Formula: C17H13NO2

Physical State: Dry powder
Available Amount: 136 mg

Lipinsky:
logP: 5.066
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 42
Number of rings: 3

     

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