COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL017283
Chemical Name: 2-(3-chlorophenyl)-6,7-dimethyl-4a,5,8,8a-tetrahydronaphthalene-1,4-dione
Smiles: O=C1C=C(c2cccc(c2)Cl)C(=O)C2C1CC(=C(C2)C)C

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Molecular Weight: 300.78
Empirical Formula: C18H17ClO2

Physical State: Dry powder
Available Amount: 33 mg

Lipinsky:
logP: 4.553
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 34
Number of rings: 3

     

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