COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675674
Chemical Name: {4-(4-bromophenyl)-1-chloro-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinolin-6-yl}(pyrrolidin-1-yl)methanone
Smiles: ClC1C(CC2C1c1cccc(c1NC2c1ccc(cc1)Br)C(=O)N1CCCC1)Sc1ccccc1[N+](=O)[O-]

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Molecular Weight: 612.97
Empirical Formula: C29H27BrClN3O3S

Available Amount: 0 mg

Lipinsky:
logP: 6.569
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 6

     

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