COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK368624
Chemical Name: 2,19-dinitro-7,8,10,11,14,15,22,23,25,26-decahydro-6H,13H-dibenzo[b,p][1,8,11,18,21,4,15,5,14]pentaoxadithiadiazacyclotricosine5,5,16,16-tetraoxide
Smiles: [O-][N+](=O)c1ccc2c(c1)OCCOCCOc1cc(ccc1S(=O)(=O)NCCOCCOCCNS2(=O)=O)[N+](=O)[O-]

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Molecular Weight: 620.62
Empirical Formula: C22H28N4O13S2

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 0.454
Rotatable bonds: 0
H-donors: 2
H-acceptors: 13
PSA: 246
Number of rings: 3

     

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