COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527639
Chemical Name: (3aS,6R)-2-[4-(ethoxycarbonyl)phenyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylicacid
Smiles: CCOC(=O)c1ccc(cc1)N1C[C@@]23C(C1=O)C([C@@H](O3)C=C2)C(=O)O

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Molecular Weight: 343.34
Empirical Formula: C18H17NO6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.015
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 93
Number of rings: 4

     

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