COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK328366
Chemical Name: 3-[(2-chloro-4-nitrophenyl)sulfanyl]-1-(pyrrolidin-1-yl)propan-1-one
Smiles: O=C(N1CCCC1)CCSc1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 314.79
Empirical Formula: C13H15ClN2O3S

Physical State: Dry powder
Available Amount: 12 mg

Lipinsky:
logP: 3.49
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 2

     

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