COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323752
Chemical Name: 2-[1-(4,4-dimethyl-2,6-dioxocyclohexyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-oxoethylpyrrolidine-1-carbodithioate
Smiles: COc1cc2c(cc1OC)CCN(C2C1C(=O)CC(CC1=O)(C)C)C(=O)CSC(=S)N1CCCC1

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Molecular Weight: 518.7
Empirical Formula: C26H34N2O5S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.107
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 133
Number of rings: 4

     

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