COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053044
Chemical Name: methyl2-({[2-amino-1-(3-chloro-4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxalin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COc1ccc(cc1Cl)n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

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Molecular Weight: 562.05
Empirical Formula: C28H24ClN5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.244
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 149
Number of rings: 6

     

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