COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL312956
Chemical Name: 2-[4-(2,2-dichlorocyclopropyl)phenoxy]-1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-methylpropan-1-one
Smiles: O=C(C(Oc1ccc(cc1)C1CC1(Cl)Cl)(C)C)N1CCC2(C(C1)CCCC2)O

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Molecular Weight: 426.38
Empirical Formula: C22H29Cl2NO3

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 3.618
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 49
Number of rings: 4

     

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