COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK094070
Chemical Name: (8R,8aS,9S,12R,13aR,13bR)-8-(phenylcarbonyl)-8,8a,9,10,13a,13b-hexahydro-9,12-epoxyoxepino[4',5':3,4]pyrrolo[2,1-a]isoquinolin-13(12H)-one
Smiles: O=C([C@@H]1N2C=Cc3c([C@H]2[C@H]2[C@@H]1[C@H]1CO[C@H](O1)C2=O)cccc3)c1ccccc1

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Molecular Weight: 373.41
Empirical Formula: C23H19NO4

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 4.322
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 55
Number of rings: 6

     

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