COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK086243
Chemical Name: 4-(hydroxymethyl)-2-(2-methoxy-4-nitrophenyl)-7-methyl-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Smiles: COc1cc(ccc1N1C(=O)C2C(C1=O)C1(OC2(C)C=C1)CO)[N+](=O)[O-]

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Molecular Weight: 360.32
Empirical Formula: C17H16N2O7

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 0.757
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 121
Number of rings: 4

     

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