COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416206
Chemical Name: (2Z,3Z)-2-(3,4-dimethoxybenzylidene)-3-(1H-1,2,4-triazol-5-ylimino)-2,3-dihydro-1H-inden-1-one
Smiles: COc1ccc(cc1OC)/C=C/1\C(=O)c2c(\C1=N\c1[nH]ncn1)cccc2

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Molecular Weight: 360.37
Empirical Formula: C20H16N4O3

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 3.186
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 4

     

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