COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL533865
Chemical Name: (3S,3aR,8aR,9aR)-3-(((1-benzylpiperidin-4-yl)amino)methyl)-8a-methyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-oneoxalate
Smiles: O=C1O[C@H]2[C@@H](C1CNC1CCN(CC1)Cc1ccccc1)CC1[C@](C2)(C)CCCC1=C

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Saltdata: (COOH)2
Molecular Weight: 422.61
Empirical Formula: C27H38N2O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.461
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 41
Number of rings: 5

     

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