COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK532649
Chemical Name: naphthalen-2-yl1-chloro-4-(3-nitrophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-6-carboxylate
Smiles: O=C(c1cccc2c1NC(c1cccc(c1)[N+](=O)[O-])C1C2C(Cl)C(C1)Sc1ccccc1[N+](=O)[O-])Oc1ccc2c(c1)cccc2

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Molecular Weight: 652.13
Empirical Formula: C35H26ClN3O6S

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 9.474
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 155
Number of rings: 7

     

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