COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540067
Chemical Name: (2E)-1-(1-hydroxynaphthalen-2-yl)-3-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}prop-2-en-1-one
Smiles: COc1ccc(cc1COc1ccc(c(c1)C)[N+](=O)[O-])/C=C/C(=O)c1ccc2c(c1O)cccc2

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Molecular Weight: 469.49
Empirical Formula: C28H23NO6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.102
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 101
Number of rings: 4

     

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