COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526533
Chemical Name: ethyl2-({[2-(4-benzylpiperazin-1-yl)-5-nitrophenyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(ccc2N2CCN(CC2)Cc2ccccc2)[N+](=O)[O-])sc2c1CCCC2

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Molecular Weight: 548.66
Empirical Formula: C29H32N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.961
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 135
Number of rings: 5

     

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