COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534607
Chemical Name: (3aR,6S)-2-[2-(1H-indol-3-yl)ethyl]-N-[2-(morpholin-4-yl)ethyl]-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: O=C(C1[C@H]2C=C[C@]3(C1C(=O)N(C3)CCc1c[nH]c3c1cccc3)O2)NCCN1CCOCC1

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Molecular Weight: 450.54
Empirical Formula: C25H30N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.835
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 86
Number of rings: 6

     

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