COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL569983
Chemical Name: 2,2'-[octane-1,8-diylbis(1H-1,2,4-triazole-3,5-diylethane-2,1-diyl)]bis(1H-isoindole-1,3(2H)-dione)
Smiles: O=C1N(CCc2[nH]nc(n2)CCCCCCCCc2n[nH]c(n2)CCN2C(=O)c3c(C2=O)cccc3)C(=O)c2c1cccc2

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Molecular Weight: 594.67
Empirical Formula: C32H34N8O4

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 4.773
Rotatable bonds: 13
H-donors: 2
H-acceptors: 4
PSA: 157
Number of rings: 6

     

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