COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL535281
Chemical Name: 3-{2-[(6R,6aR,13R,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]-2-oxoethyl}-7-hydroxy-4,8-dimethyl-2H-chromen-2-one
Smiles: O=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Cc1c(=O)oc2c(c1C)ccc(c2C)O

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Molecular Weight: 462.59
Empirical Formula: C28H34N2O4

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 5.644
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 70
Number of rings: 6

     

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