COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK090073
Chemical Name: N,N,4-trimethyl-3-(4-nitrophenyl)-3a,4,9,9a-tetrahydro-3H-pyrrolo[2,3-b]quinoxalin-2-amine
Smiles: CN(C1=NC2C(C1c1ccc(cc1)[N+](=O)[O-])N(C)c1c(N2)cccc1)C

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Molecular Weight: 351.41
Empirical Formula: C19H21N5O2

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 2.658
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 76
Number of rings: 4

     

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