COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK199315
Chemical Name: 3-chloro-N-({4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazin-1-yl}carbonothioyl)benzamide
Smiles: Clc1cccc(c1)C(=O)NC(=S)N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)[N+](=O)[O-]

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Molecular Weight: 488.01
Empirical Formula: C23H26ClN5O3S

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 5.3
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 4

     

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