COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK991744
Chemical Name: (5Z)-5-[(1,3-benzodioxol-5-ylamino)methylidene]-1-[2-(1H-indol-3-yl)ethyl]-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(C)/C(=C/Nc2ccc3c(c2)OCO3)/C(=O)N(C1=O)CCc1c[nH]c2c1cccc2

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Molecular Weight: 440.46
Empirical Formula: C25H20N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.589
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 107
Number of rings: 5

     

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