COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK671391
Chemical Name: N,N'-{sulfanediylbis[(1-oxoethane-2,1-diyl)(1E)hydrazin-2-yl-1-ylidene(1E)eth-1-yl-1-ylidenebenzene-4,1-diyl]}bis(3,5-dinitrobenzamide)
Smiles: O=C(N/N=C(/c1ccc(cc1)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])\C)CSCC(=O)N/N=C(/c1ccc(cc1)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])\C

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Molecular Weight: 800.72
Empirical Formula: C34H28N10O12S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.583
Rotatable bonds: 5
H-donors: 4
H-acceptors: 12
PSA: 349
Number of rings: 4

     

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