COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK040481
Chemical Name: N,N'-{[(1E)-3-oxoprop-1-ene-1,3-diyl]dibenzene-4,1-diyl}bis(1,3-dioxo-2-{4-[(E)-phenyldiazenyl]phenyl}-2,3-dihydro-1H-isoindole-5-carboxamide)
Smiles: O=C(c1ccc(cc1)NC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)/N=N/c1ccccc1)/C=C/c1ccc(cc1)NC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)/N=N/c1ccccc1

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Molecular Weight: 944.96
Empirical Formula: C57H36N8O7

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 8.817
Rotatable bonds: 3
H-donors: 2
H-acceptors: 7
PSA: 199
Number of rings: 10

     

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