COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK007983
Chemical Name: 3-{[2-(2,4-dichlorophenyl)-2-hydroxyethyl]sulfanyl}-1-ethyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCC(c2ccc(cc2Cl)Cl)O)nc(c2c1CCCC2)CC

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Molecular Weight: 407.36
Empirical Formula: C20H20Cl2N2OS

Available Amount: 0 mg

Lipinsky:
logP: 6.511
Rotatable bonds: 6
H-donors: 1
H-acceptors: 1
PSA: 82
Number of rings: 3

     

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