COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK092383
Chemical Name: 4-[(4-hydroxypiperidin-1-yl)carbonothioyl]phenyl2-chloro-4-nitrobenzoate
Smiles: OC1CCN(CC1)C(=S)c1ccc(cc1)OC(=O)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 420.87
Empirical Formula: C19H17ClN2O5S

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 2.76
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 127
Number of rings: 3

     

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