COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323877
Chemical Name: 4-[4-(dimethylamino)phenyl]-7,7-dimethyl-5-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccccc2)nc2c(c1c1ccc(cc1)N(C)C)C(=O)CC(C2)(C)C

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Molecular Weight: 469.61
Empirical Formula: C28H27N3O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.343
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 99
Number of rings: 4

     

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