COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK326030
Chemical Name: 1-chloro-4-(naphthalen-1-yl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylicacid
Smiles: OC(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1cccc2c1cccc2)Sc1ccccc1[N+](=O)[O-]

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Molecular Weight: 531.03
Empirical Formula: C29H23ClN2O4S

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 7.361
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 120
Number of rings: 6

     

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