COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK420605
Chemical Name: propan-2-yl2-({[2-(3,4-dimethoxyphenyl)quinolin-4-yl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COc1cc(ccc1OC)c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCCC2

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Molecular Weight: 544.67
Empirical Formula: C31H32N2O5S

Physical State: Dry powder
Available Amount: 964 mg

Lipinsky:
logP: 8.559
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 114
Number of rings: 5

     

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