COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL544175
Chemical Name: 6-acetyl-4-(7-chloro-1,3-benzodioxol-5-yl)-5-hydroxy-3,4-dihydro-2H-chromen-2-one
Smiles: O=C1Oc2ccc(c(c2C(C1)c1cc(Cl)c2c(c1)OCO2)O)C(=O)C

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Molecular Weight: 360.75
Empirical Formula: C18H13ClO6

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 4.04
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 82
Number of rings: 4

     

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