COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK886450
Chemical Name: 4-(4-ethoxyphenyl)-2-{[2-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-5-oxo-1,4,4a,5,6,7,8,8a-octahydroquinoline-3-carbonitrile
Smiles: CCOc1ccc(cc1)C1C2C(CCCC2=O)NC(=C1C#N)SCC(=O)N1C(C)Cc2c1cccc2

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Molecular Weight: 501.65
Empirical Formula: C29H31N3O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.14
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 5

     

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