COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561021
Chemical Name: 2-[(2-chlorobenzyl)sulfanyl]-5-hydroxy-4-(4-methoxyphenyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(SCc2ccccc2Cl)N=C2C(=C(O)CCC2)C1c1ccc(cc1)OC

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Molecular Weight: 436.96
Empirical Formula: C24H21ClN2O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.8
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 90
Number of rings: 4

     

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