COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531946
Chemical Name: 1-{1-chloro-4-(2,4-dichlorophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinolin-8-yl}ethanone
Smiles: Clc1ccc(c(c1)Cl)C1Nc2ccc(cc2C2C1CC(C2Cl)Sc1ccccc1[N+](=O)[O-])C(=O)C

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Molecular Weight: 547.89
Empirical Formula: C26H21Cl3N2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.104
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 100
Number of rings: 5

     

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