COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185267
Chemical Name: (2E)-2-cyano-3-(2,5-dimethyl-1-{4-[(5-nitropyridin-2-yl)oxy]phenyl}-1H-pyrrol-3-yl)-N-(2-fluorophenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)Oc1ccc(cn1)[N+](=O)[O-])C)/C(=O)Nc1ccccc1F

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Molecular Weight: 497.49
Empirical Formula: C27H20FN5O4

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 5.13
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 125
Number of rings: 4

     

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