COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK336671
Chemical Name: 2-chloro-4-nitro-N-{[2-(pyrrolidin-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide
Smiles: S=C(NC(=O)c1ccc(cc1Cl)[N+](=O)[O-])Nc1cc(ccc1N1CCCC1)C(F)(F)F

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Molecular Weight: 472.88
Empirical Formula: C19H16ClF3N4O3S

Physical State: Dry powder
Available Amount: 609 mg

Lipinsky:
logP: 5.272
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 122
Number of rings: 3

     

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