COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL033742
Chemical Name: 4-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-7,8-dihydroxy-2H-chromen-2-one
Smiles: Clc1cccc(c1)N1CCN(CC1)Cc1cc(=O)oc2c1ccc(c2O)O

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Saltdata: 2HCl
Molecular Weight: 386.83
Empirical Formula: C20H19ClN2O4

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.195
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 73
Number of rings: 4

     

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