COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185297
Chemical Name: (2E)-2-cyano-3-[2,5-dimethyl-1-(4-methyl-3-nitrophenyl)-1H-pyrrol-3-yl]-N-(3-methylphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc(c(c1)[N+](=O)[O-])C)C)/C(=O)Nc1cccc(c1)C

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Molecular Weight: 414.46
Empirical Formula: C24H22N4O3

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 5.817
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 3

     

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