COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK109555
Chemical Name: 2-(4-chloro-2-nitrophenyl)-4,7-dimethyl-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Smiles: Clc1ccc(c(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C1(OC2(C)C=C1)C

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Molecular Weight: 348.74
Empirical Formula: C16H13ClN2O5

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 2.385
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 92
Number of rings: 4

     

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