COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050952
Chemical Name: ethyl2-({[2-amino-1-(4-ethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxalin-3-yl]carbonyl}amino)-3a,4,5,6,7,7a-hexahydro-1-benzothiophene-3-carboxylate
Smiles: CCOc1ccc(cc1)n1c2nc3ccccc3nc2c(c1N)C(=O)NC1=C(C(=O)OCC)C2C(S1)CCCC2

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Molecular Weight: 557.67
Empirical Formula: C30H31N5O4S

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 5.209
Rotatable bonds: 5
H-donors: 3
H-acceptors: 4
PSA: 146
Number of rings: 6

     

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