COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK724529
Chemical Name: ethyl2-[({2-[(4-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinolin-3-yl}carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2)NC(=O)C1Cc2ccccc2CN1S(=O)(=O)c1ccc(cc1)C

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Molecular Weight: 538.69
Empirical Formula: C28H30N2O5S2

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 7.43
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 5

     

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