COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL562715
Chemical Name: (3S,3aR,8aR,9aR)-3-(((benzo[d][1,3]dioxol-5-ylmethyl)amino)methyl)-5,8a-dimethyl-3a,4,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(3H)-one
Smiles: O=C1O[C@H]2[C@@H](C1CNCc1ccc3c(c1)OCO3)CC1=C(C)CCC[C@@]1(C2)C

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Molecular Weight: 383.49
Empirical Formula: C23H29NO4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.469
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 56
Number of rings: 5

     

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