COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL034975
Chemical Name: 2-{[(6-ethyl-7-hydroxy-2-oxo-2H-chromen-4-yl)methyl]sulfanyl}-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1c(SCc2cc(=O)oc3c2cc(CC)c(c3)O)nc2c(c1C(F)(F)F)CCCC2

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Molecular Weight: 460.48
Empirical Formula: C23H19F3N2O3S

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 7.277
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 108
Number of rings: 4

     

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