COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK107438
Chemical Name: (2E)-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide
Smiles: O=C(NC(=S)Nc1ccc2c3c1cccc3CC2)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 403.46
Empirical Formula: C22H17N3O3S

Physical State: Dry powder
Available Amount: 504 mg

Lipinsky:
logP: 5.665
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 119
Number of rings: 4

     

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