COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK855420
Chemical Name: (3E)-6-chloro-3-[(3E)-2-oxo-4-phenylbut-3-en-1-ylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Smiles: O=C(/C=c\1/[nH]c2cc(Cl)ccc2oc1=O)/C=C/c1ccccc1

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Molecular Weight: 325.75
Empirical Formula: C18H12ClNO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.676
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 55
Number of rings: 3

     

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