COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL222122
Chemical Name: (3aS,4R,9bR)-6-bromo-8,9-dimethyl-4-(4-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Smiles: Brc1cc(C)c(c2c1N[C@@H](c1ccc(cc1)[N+](=O)[O-])[C@@H]1[C@H]2C=CC1)C

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Molecular Weight: 399.29
Empirical Formula: C20H19BrN2O2

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 5.059
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 57
Number of rings: 4

     

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