COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK091341
Chemical Name: 3-{[2-(2,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-1-methyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2Cl)Cl)nc(c2c1CCCC2)C

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Molecular Weight: 391.32
Empirical Formula: C19H16Cl2N2OS

Physical State: Dry powder
Available Amount: 423 mg

Lipinsky:
logP: 6.036
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 79
Number of rings: 3

     

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