COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK179438
Chemical Name: {2-bromo-4-[(1E)-2-cyano-3-(naphthalen-2-ylamino)-3-oxoprop-1-en-1-yl]phenoxy}aceticacid
Smiles: N#C/C(=C\c1ccc(c(c1)Br)OCC(=O)O)/C(=O)Nc1ccc2c(c1)cccc2

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Molecular Weight: 451.28
Empirical Formula: C22H15BrN2O4

Physical State: Dry powder
Available Amount: 289 mg

Lipinsky:
logP: 4.401
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 99
Number of rings: 3

     

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