COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK944921
Chemical Name: diethyl5,5'-{piperazine-1,4-diylbis[(2-hydroxypropane-3,1-diyl)oxy]}bis[2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate]
Smiles: CCOC(=O)c1c(C)n(c2c1cc(OCC(CN1CCN(CC1)CC(COc1ccc3c(c1)c(C(=O)OCC)c(n3c1ccc(cc1)C)C)O)O)cc2)c1ccc(cc1)C

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Molecular Weight: 816.99
Empirical Formula: C48H56N4O8

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 10.856
Rotatable bonds: 16
H-donors: 2
H-acceptors: 8
PSA: 127
Number of rings: 7

     

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