COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK611370
Chemical Name: (3aS,6R,7aR)-N-[3-(diethylamino)propyl]-2-(4-methoxyphenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Smiles: CCN(CCCNC(=O)C1[C@@H]2C=C[C@@]3([C@@H]1C(=O)N(C3)c1ccc(cc1)OC)O2)CC

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Molecular Weight: 413.52
Empirical Formula: C23H31N3O4

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 1.99
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 4

     

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