COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK024505
Chemical Name: 4,5,6,7,8,8-hexachloro-2-(4-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)C2C1C1(Cl)C(=C(C2(C1(Cl)Cl)Cl)Cl)Cl

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Molecular Weight: 490.94
Empirical Formula: C15H6Cl6N2O4

Physical State: Dry powder
Available Amount: 367 mg

Lipinsky:
logP: 5.087
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 83
Number of rings: 4

     

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