COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK427893
Chemical Name: ethyl2-({[2-(2-chlorophenyl)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)c1ccccc1Cl

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Molecular Weight: 519.06
Empirical Formula: C29H27ClN2O3S

Physical State: Dry powder
Available Amount: 2505 mg

Lipinsky:
logP: 9.767
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 5

     

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