COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL479669
Chemical Name: 4-[(1E)-2-cyano-3-oxo-3-(prop-2-en-1-ylamino)prop-1-en-1-yl]-2-methoxyphenyl2-(3-bromophenoxy)propanoate
Smiles: C=CCNC(=O)/C(=C/c1ccc(c(c1)OC)OC(=O)C(Oc1cccc(c1)Br)C)/C#N

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Molecular Weight: 485.33
Empirical Formula: C23H21BrN2O5

Available Amount: 0 mg

Lipinsky:
logP: 4.176
Rotatable bonds: 10
H-donors: 1
H-acceptors: 5
PSA: 97
Number of rings: 2

     

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