COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546752
Chemical Name: (12aS)-2-{[(E)-(4-ethoxyphenyl)methylidene]amino}-6-phenyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCOc1ccc(cc1)/C=N/N1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccccc2)[nH]c2c1cccc2

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Molecular Weight: 478.55
Empirical Formula: C29H26N4O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.448
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 6

     

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