COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK008777
Chemical Name: (3aS,4R,9bR)-4-[4-(morpholin-4-ylsulfonyl)phenyl]-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Smiles: [O-][N+](=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](N2)c1ccc(cc1)S(=O)(=O)N1CCOCC1

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Molecular Weight: 441.51
Empirical Formula: C22H23N3O5S

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 3.016
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 112
Number of rings: 5

     

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