COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK384110
Chemical Name: butyl1-oxo-2-(thiophen-2-ylmethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Smiles: CCCCOC(=O)C1C2C=CC3(C1C(=O)N(C3)Cc1cccs1)O2

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Molecular Weight: 347.44
Empirical Formula: C18H21NO4S

Physical State: Dry powder
Available Amount: 605 mg

Lipinsky:
logP: 3.355
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 84
Number of rings: 4

     

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