COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185345
Chemical Name: 3-({4-[(1E)-2-cyano-3-(morpholin-4-yl)-3-oxoprop-1-en-1-yl]phenoxy}methyl)benzoicacid
Smiles: N#C/C(=C\c1ccc(cc1)OCc1cccc(c1)C(=O)O)/C(=O)N1CCOCC1

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Molecular Weight: 392.41
Empirical Formula: C22H20N2O5

Physical State: Dry powder
Available Amount: 71 mg

Lipinsky:
logP: 2.123
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 99
Number of rings: 3

     

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