COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL222112
Chemical Name: (3aS,4R,9bR)-4-(2,4-dichlorophenyl)-6-methoxy-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Smiles: COc1cc(cc2c1N[C@H]([C@@H]1[C@H]2C=CC1)c1ccc(cc1Cl)Cl)[N+](=O)[O-]

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Molecular Weight: 391.25
Empirical Formula: C19H16Cl2N2O3

Physical State: Dry powder
Available Amount: 29 mg

Lipinsky:
logP: 5.89
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 67
Number of rings: 4

     

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