COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK467336
Chemical Name: (2E)-3-{5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}-2-cyano-N-(2-methoxy-5-methylphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)Cn1cc(c(n1)[N+](=O)[O-])Cl)/C(=O)Nc1cc(C)ccc1OC

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Molecular Weight: 441.83
Empirical Formula: C20H16ClN5O5

Physical State: Dry powder
Available Amount: 351 mg

Lipinsky:
logP: 3.563
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 138
Number of rings: 3

     

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