COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322513
Chemical Name: (2E)-3-(7-chloro-4H-1,3-benzodioxin-5-yl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one
Smiles: Clc1cc(/C=C/C(=O)c2ccc3c(c2O)cccc3)c2c(c1)OCOC2

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Molecular Weight: 366.8
Empirical Formula: C21H15ClO4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.24
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 55
Number of rings: 4

     

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