COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK364342
Chemical Name: 1-chloro-6-methoxy-4-(4-nitrophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline
Smiles: COc1cccc2c1NC(c1ccc(cc1)[N+](=O)[O-])C1C2C(Cl)C(C1)Sc1ccccc1[N+](=O)[O-]

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Molecular Weight: 511.99
Empirical Formula: C25H22ClN3O5S

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 5.967
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 138
Number of rings: 5

     

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