COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK393305
Chemical Name: (2E)-N-[(3-acetylphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide
Smiles: O=C(NC(=S)Nc1cccc(c1)C(=O)C)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 369.4
Empirical Formula: C18H15N3O4S

Physical State: Dry powder
Available Amount: 204 mg

Lipinsky:
logP: 3.492
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 136
Number of rings: 2

     

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