COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL033741
Chemical Name: 7,8-dihydroxy-4-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-2H-chromen-2-one
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2O)O

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Saltdata: 2HCl
Molecular Weight: 382.42
Empirical Formula: C21H22N2O5

Physical State: Dry powder
Available Amount: 334 mg

Lipinsky:
logP: 3.046
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 82
Number of rings: 4

     

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