COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534736
Chemical Name: tert-butyl[(12aR)-6-(3-nitrophenyl)-1,4-dioxo-3,4,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-2(1H)-yl]carbamate
Smiles: O=C(OC(C)(C)C)NN1CC(=O)N2[C@@H](C1=O)Cc1c(C2c2cccc(c2)[N+](=O)[O-])[nH]c2c1cccc2

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Molecular Weight: 491.5
Empirical Formula: C25H25N5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.549
Rotatable bonds: 3
H-donors: 2
H-acceptors: 6
PSA: 140
Number of rings: 5

     

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