COMPOUNDS FOR BIOLOGICAL SCREENING
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Vitas-M Lab ID: STK380682
Chemical Name: (2E)-2-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-3-[2,5-dimethyl-1-(2-methyl-4-nitrophenyl)-1H-pyrrol-3-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc(cc1C)[N+](=O)[O-])C)/C(=O)N1CCc2c(C1)cccc2

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Molecular Weight: 440.5
Empirical Formula: C26H24N4O3

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 5.302
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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