COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK557209
Chemical Name: ethyl5,6-dimethoxy-3-{[(2E)-2,3,4,5,5-pentachloropenta-2,4-dienoyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)/C(=C(/C(=C(Cl)Cl)Cl)\Cl)/Cl)cc(c(c2)OC)OC

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Molecular Weight: 516.59
Empirical Formula: C18H15Cl5N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.261
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 89
Number of rings: 2

     

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