COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL541825
Chemical Name: 8-[1-(3,4-dimethoxyphenyl)-3-(4-methylpiperazin-1-yl)-3-oxopropyl]-5,6,7-trihydroxy-2-phenyl-4H-chromen-4-one
Smiles: COc1cc(ccc1OC)C(c1c(O)c(O)c(c2c1oc(cc2=O)c1ccccc1)O)CC(=O)N1CCN(CC1)C

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Molecular Weight: 560.6
Empirical Formula: C31H32N2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.315
Rotatable bonds: 9
H-donors: 3
H-acceptors: 8
PSA: 129
Number of rings: 5

     

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