COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546696
Chemical Name: 1-[(6R,6aR,13aS)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-yl]-5-(1,2-dithiolan-3-yl)pentan-1-one
Smiles: O=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)CCCCC1CCSS1

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Molecular Weight: 420.68
Empirical Formula: C23H36N2OS2

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 5.106
Rotatable bonds: 5
H-donors: 0
H-acceptors: 1
PSA: 74
Number of rings: 5

     

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