COMPOUNDS FOR BIOLOGICAL SCREENING
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Vitas-M Lab ID: STK467132
Chemical Name: (2E)-3-[3-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enamide
Smiles: N#C/C(=C\c1c[nH]nc1c1ccc(cc1)Br)/C(=O)Nc1ccc2c(c1)OCCO2

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Molecular Weight: 451.28
Empirical Formula: C21H15BrN4O3

Physical State: Dry powder
Available Amount: 362 mg

Lipinsky:
logP: 4.339
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 100
Number of rings: 4

     

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