COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL461188
Chemical Name: 7-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-3-[3-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-oxopropyl]-4-methyl-2H-chromen-2-one
Smiles: O=C(N1CCC2(C(C1)CCCC2)O)CCc1c(=O)oc2c(c1C)ccc(c2)OCc1cc2OCOc2cc1Cl

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Molecular Weight: 554.04
Empirical Formula: C30H32ClNO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.737
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 94
Number of rings: 6

     

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