COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK391268
Chemical Name: (2E)-3-(3-nitrophenyl)-N-[(pyridin-3-ylmethyl)carbamothioyl]prop-2-enamide
Smiles: S=C(NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-])NCc1cccnc1

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Molecular Weight: 342.38
Empirical Formula: C16H14N4O3S

Physical State: Dry powder
Available Amount: 191 mg

Lipinsky:
logP: 2.228
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 131
Number of rings: 2

     

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