COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK428963
Chemical Name: 6-bromo-2-(4-butylphenyl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)quinoline-4-carboxamide
Smiles: CCCCc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)Nc1sc2c(c1C#N)CCCCC2)Br

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Molecular Weight: 558.54
Empirical Formula: C30H28BrN3OS

Physical State: Dry powder
Available Amount: 530 mg

Lipinsky:
logP: 9.507
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 94
Number of rings: 5

     

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