COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK574509
Chemical Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-oxo-7-phenyl-2H-chromen-6-olate
Smiles: O=c1oc2cc(c3ccccc3)c(cc2c(c1)C[NH+]1CCN(CC1)Cc1ccccc1)[O-]

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Molecular Weight: 426.52
Empirical Formula: C27H26N2O3

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 3.894
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 57
Number of rings: 5

     

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