COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL280649
Chemical Name: (3aS,4R,9bR)-8-bromo-4-(2,3-dimethoxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylicacid
Smiles: COc1cccc(c1OC)[C@@H]1Nc2c([C@H]3[C@@H]1CC=C3)cc(cc2C(=O)O)Br

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Molecular Weight: 430.3
Empirical Formula: C21H20BrNO4

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 5.548
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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