COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK728135
Chemical Name: (3aR,4S,9bS)-8-bromo-4-(2-chloro-5-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Smiles: Brc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](N2)c1cc(ccc1Cl)[N+](=O)[O-]

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Molecular Weight: 405.68
Empirical Formula: C18H14BrClN2O2

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 5.272
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 57
Number of rings: 4

     

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