COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052747
Chemical Name: 4-({(2R,3S,4S)-2-ethyl-1-[(4-methoxyphenyl)carbonyl]-3-methyl-1,2,3,4-tetrahydroquinolin-4-yl}amino)phenylthiocyanate
Smiles: CC[C@@H]1[C@@H](C)[C@H](Nc2ccc(cc2)SC#N)c2c(N1C(=O)c1ccc(cc1)OC)cccc2

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Molecular Weight: 457.6
Empirical Formula: C27H27N3O2S

Physical State: Dry powder
Available Amount: 158 mg

Lipinsky:
logP: 5.616
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 90
Number of rings: 4

     

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