COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK549761
Chemical Name: {1-chloro-4-(3-nitrophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinolin-8-yl}(2-methylpiperidin-1-yl)methanone
Smiles: ClC1C(CC2C1c1cc(ccc1NC2c1cccc(c1)[N+](=O)[O-])C(=O)N1CCCCC1C)Sc1ccccc1[N+](=O)[O-]

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Molecular Weight: 607.13
Empirical Formula: C31H31ClN4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.897
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 149
Number of rings: 6

     

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