COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK783759
Chemical Name: 2-amino-4-(1,3-benzodioxol-5-yl)-5-oxo-1-[(6-oxo-3-phenyl-1,6-dihydropyridazin-4-yl)amino]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(Nc2cc(=O)[nH]nc2c2ccccc2)C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2

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Molecular Weight: 494.51
Empirical Formula: C27H22N6O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.691
Rotatable bonds: 2
H-donors: 4
H-acceptors: 4
PSA: 142
Number of rings: 6

     

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