COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540563
Chemical Name: methyl2-[({2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxalin-3-yl}carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COc1cc(ccc1OC)CCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

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Molecular Weight: 585.68
Empirical Formula: C31H31N5O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.951
Rotatable bonds: 8
H-donors: 3
H-acceptors: 5
PSA: 158
Number of rings: 6

     

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