COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL465678
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)prop-2-en-1-one
Smiles: O=C(N1CCc2c(C1)c1ccccc1[nH]2)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 346.39
Empirical Formula: C21H18N2O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.67
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 54
Number of rings: 5

     

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