COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL540775
Chemical Name: 6-{[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[2-(2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl)ethyl]hexanamide
Smiles: COc1c2c(CCC(c3c2ccc(c(=O)c3)NCCCCCC(=O)NCCn2c(=O)c(=O)[nH]c3c2cccc3)NC(=O)C)cc(c1OC)OC

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Molecular Weight: 685.78
Empirical Formula: C37H43N5O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.881
Rotatable bonds: 13
H-donors: 4
H-acceptors: 8
PSA: 164
Number of rings: 5

     

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