COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK201600
Chemical Name: (2E)-3-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-(3-fluorophenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1cc(n(c1C)c1ccc2c(c1)OCO2)C)/c1cccc(c1)F

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Molecular Weight: 360.39
Empirical Formula: C22H17FN2O2

Physical State: Dry powder
Available Amount: 23 mg

Lipinsky:
logP: 6.252
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 47
Number of rings: 4

     

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