COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK625015
Chemical Name: (3aS,6R)-2-[4-(acetylamino)phenyl]-1-oxo-N-(pyridin-4-ylmethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: CC(=O)Nc1ccc(cc1)N1C[C@@]23C(C1=O)C([C@@H](O3)C=C2)C(=O)NCc1ccncc1

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Molecular Weight: 418.45
Empirical Formula: C23H22N4O4

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: -0.095
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 100
Number of rings: 5

     

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