COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK113584
Chemical Name: 4-(3-bromo-4,5-dimethoxyphenyl)-6-methyl-8-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Smiles: COc1c(Br)cc(cc1OC)C1Nc2c(C)cc(cc2C2C1CC=C2)[N+](=O)[O-]

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Molecular Weight: 445.31
Empirical Formula: C21H21BrN2O4

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 5.057
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 76
Number of rings: 4

     

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