COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL465660
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-1-(8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)prop-2-en-1-one
Smiles: COc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 376.41
Empirical Formula: C22H20N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.586
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 5

     

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