COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL222052
Chemical Name: (3aS,4R,9bR)-N-(2-methoxy-5-methylphenyl)-4-(2-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide
Smiles: COc1ccc(cc1NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](N2)c1ccccc1[N+](=O)[O-])C

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Molecular Weight: 491.57
Empirical Formula: C26H25N3O5S

Physical State: Dry powder
Available Amount: 31 mg

Lipinsky:
logP: 4.983
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 121
Number of rings: 5

     

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