COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL541423
Chemical Name: 5,6,7-trihydroxy-8-[1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-phenyl-4H-chromen-4-one
Smiles: COc1cc(cc(c1O)OC)C(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)CC(=O)N1CCN(CC1)C

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Molecular Weight: 576.6
Empirical Formula: C31H32N2O9

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.132
Rotatable bonds: 9
H-donors: 4
H-acceptors: 9
PSA: 149
Number of rings: 5

     

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