COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK156675
Chemical Name: 2,2'-(sulfanediyldibenzene-4,1-diyl)bis(5-nitro-1H-isoindole-1,3(2H)-dione)
Smiles: O=C1c2cc(ccc2C(=O)N1c1ccc(cc1)Sc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 566.51
Empirical Formula: C28H14N4O8S

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 4.273
Rotatable bonds: 0
H-donors: 0
H-acceptors: 8
PSA: 191
Number of rings: 6

     

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