COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK949650
Chemical Name: (2E)-3-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-1-[4-(propan-2-yloxy)phenyl]prop-2-en-1-one
Smiles: CC(Oc1ccc(cc1)C(=O)/C=C/c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])Cl)C

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Molecular Weight: 411.84
Empirical Formula: C22H18ClNO5

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.36
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 85
Number of rings: 3

     

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