COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK779911
Chemical Name: 3-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl}-6-bromo-8-methoxy-2H-chromen-2-one
Smiles: COc1cc(Br)cc2c1oc(=O)c(c2)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 501.33
Empirical Formula: C23H21BrN2O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.042
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 77
Number of rings: 5

     

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