COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK323927
Chemical Name: (2E)-3-(3,4-dimethoxyphenyl)-N-[(2-hydroxy-4-nitrophenyl)carbamothioyl]prop-2-enamide
Smiles: COc1ccc(cc1OC)/C=C/C(=O)NC(=S)Nc1ccc(cc1O)[N+](=O)[O-]

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Molecular Weight: 403.42
Empirical Formula: C18H17N3O6S

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 4.433
Rotatable bonds: 5
H-donors: 3
H-acceptors: 6
PSA: 157
Number of rings: 2

     

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