COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK329286
Chemical Name: 1,6,8-trichloro-4-(2,3-dichlorophenyl)-2-[(2-nitrophenyl)sulfanyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Smiles: Clc1cc(Cl)c2c(c1)C1C(=C(CC1C(N2)c1cccc(c1Cl)Cl)Sc1ccccc1[N+](=O)[O-])Cl

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Molecular Weight: 572.72
Empirical Formula: C24H15Cl5N2O2S

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 7.565
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 83
Number of rings: 5

     

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