COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK389708
Chemical Name: N-{[3-chloro-2-(pyrrolidin-1-yl)phenyl]carbamothioyl}-2-nitrobenzamide
Smiles: S=C(Nc1cccc(c1N1CCCC1)Cl)NC(=O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 404.88
Empirical Formula: C18H17ClN4O3S

Physical State: Dry powder
Available Amount: 76 mg

Lipinsky:
logP: 3.899
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 122
Number of rings: 3

     

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