COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541629
Chemical Name: phenyl(6aR,6bS,9aR,10S)-7,9-dioxo-8-[3-(trifluoromethyl)phenyl]-6b,7,8,9,9a,10-hexahydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-10-carboxylate
Smiles: O=C([C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc(c1)C(F)(F)F)C=Cc1c2cccc1)Oc1ccccc1

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Molecular Weight: 504.47
Empirical Formula: C28H19F3N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.169
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 66
Number of rings: 6

     

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