COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK619143
Chemical Name: ethyl4-({(3aS,6R)-2-[4-(acetylamino)phenyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindol-7-yl}carbonyl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)C1[C@@H]2C=C[C@@]3(C1C(=O)N(C3)c1ccc(cc1)NC(=O)C)O2

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Molecular Weight: 468.51
Empirical Formula: C24H28N4O6

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 1.362
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 108
Number of rings: 5

     

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