COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK426930
Chemical Name: ethyl2-({[2-(3-methylphenyl)quinolin-4-yl]carbonyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCCCC2)NC(=O)c1cc(nc2c1cccc2)c1cccc(c1)C

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Molecular Weight: 498.65
Empirical Formula: C30H30N2O3S

Physical State: Dry powder
Available Amount: 1147 mg

Lipinsky:
logP: 9.749
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 5

     

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