COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL176011
Chemical Name: (2E)-3-{3-[(2-benzylphenoxy)methyl]-4-methoxyphenyl}-1-(thiophen-2-yl)prop-2-en-1-one
Smiles: COc1ccc(cc1COc1ccccc1Cc1ccccc1)/C=C/C(=O)c1cccs1

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Molecular Weight: 440.56
Empirical Formula: C28H24O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.121
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 63
Number of rings: 4

     

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