COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK744752
Chemical Name: 2,2'-[(3,3-dimethyl-1,5-dioxopentane-1,5-diyl)diimino]bis(4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylicacid)
Smiles: O=C(CC(CC(=O)Nc1sc2c(c1C(=O)O)CCCC2)(C)C)Nc1sc2c(c1C(=O)O)CCCC2

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Molecular Weight: 518.66
Empirical Formula: C25H30N2O6S2

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 8.032
Rotatable bonds: 8
H-donors: 4
H-acceptors: 6
PSA: 189
Number of rings: 4

     

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