COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565948
Chemical Name: 2-[(2-chlorobenzyl)sulfanyl]-5-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(SCc2ccccc2Cl)N=C2C(=C(O)CCC2)C1c1ccc(c(c1)OC)O

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Molecular Weight: 452.96
Empirical Formula: C24H21ClN2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.853
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 111
Number of rings: 4

     

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