COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK049737
Chemical Name: 4-{(1E)-2-cyano-3-[(2-methoxy-5-nitrophenyl)amino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl3-fluorobenzoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1cccc(c1)F)/C(=O)Nc1cc(ccc1OC)[N+](=O)[O-]

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Molecular Weight: 491.43
Empirical Formula: C25H18FN3O7

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 5.447
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 143
Number of rings: 3

     

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