COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK448879
Chemical Name: ethyl2-({[2-(2,4-dichlorophenyl)-3-methylquinolin-4-yl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCCC2)NC(=O)c1c(C)c(nc2c1cccc2)c1ccc(cc1Cl)Cl

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Molecular Weight: 553.51
Empirical Formula: C29H26Cl2N2O3S

Physical State: Dry powder
Available Amount: 374 mg

Lipinsky:
logP: 10.245
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 5

     

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