COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL326731
Chemical Name: 2-acetyl-4,5,6,7,8,8-hexachloro-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene-1,3(2H)-dione
Smiles: CC(=O)C1C(=O)C2C(C1=O)C1(C(C2(Cl)C(=C1Cl)Cl)(Cl)Cl)Cl

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Molecular Weight: 410.89
Empirical Formula: C12H6Cl6O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.526
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 3

     

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