COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK445000
Chemical Name: dipropyl2,2'-[(1,5-dioxopentane-1,5-diyl)diimino]bis(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate)
Smiles: CCCOC(=O)c1c(NC(=O)CCCC(=O)Nc2sc3c(c2C(=O)OCCC)CCC(C3)C)sc2c1CCC(C2)C

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Molecular Weight: 602.82
Empirical Formula: C31H42N2O6S2

Physical State: Dry powder
Available Amount: 1105 mg

Lipinsky:
logP: 10.055
Rotatable bonds: 12
H-donors: 2
H-acceptors: 6
PSA: 167
Number of rings: 4

     

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