COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL542617
Chemical Name: (3aS,6R,7aR)-N-(3,5-dimethoxyphenyl)-1-oxo-2-(pyridin-4-ylmethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: COc1cc(NC(=O)C2[C@@H]3C=C[C@@]4([C@@H]2C(=O)N(C4)Cc2ccncc2)O3)cc(c1)OC

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Molecular Weight: 421.45
Empirical Formula: C23H23N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.753
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 89
Number of rings: 5

     

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