COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK606990
Chemical Name: (2E)-4-[5'-(3-nitrophenyl)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrazol]-2'(4'H)-yl]-4-oxobut-2-enoicacid
Smiles: OC(=O)/C=C/C(=O)N1N=C(CC21C(=O)Nc1c2cccc1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 406.35
Empirical Formula: C20H14N4O6

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 1.342
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 144
Number of rings: 4

     

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